N-[2-(S)-(3,4-DICHLOROPHENYL)-4-[4-[(S)-2-METHYLSULFINYLPHENYL]-1-PIPERIDINYL]-BUTYL]-N-METHYL-3-CYANO-4-FLUORO-1-NAPHTHAMIDE-CITRATE-HYDRATE
Compound with spectra: 1 NMR
![N-[2-(S)-(3,4-DICHLOROPHENYL)-4-[4-[(S)-2-METHYLSULFINYLPHENYL]-1-PIPERIDINYL]-BUTYL]-N-METHYL-3-CYANO-4-FLUORO-1-NAPHTHAMIDE-CITRATE-HYDRATE](/api/compound/EsTcIAgB5qr.png?ph=true&h=300&w=458 "N-[2-(S)-(3,4-DICHLOROPHENYL)-4-[4-[(S)-2-METHYLSULFINYLPHENYL]-1-PIPERIDINYL]-BUTYL]-N-METHYL-3-CYANO-4-FLUORO-1-NAPHTHAMIDE-CITRATE-HYDRATE")
| SpectraBase Compound ID | EsTcIAgB5qr |
|---|---|
| InChI | InChI=1S/C35H34Cl2FN3O2S/c1-40(35(42)30-19-26(21-39)34(38)29-9-4-3-8-28(29)30)22-25(24-11-12-31(36)32(37)20-24)15-18-41-16-13-23(14-17-41)27-7-5-6-10-33(27)44(2)43/h3-12,19-20,23,25H,13-18,22H2,1-2H3/t25-,44?/m1/s1 |
| InChIKey | UVHGUYSARRYVMH-RAFHQAEPSA-N |
| Mol Weight | 650.6 g/mol |
| Molecular Formula | C35H34Cl2FN3O2S |
| Exact Mass | 649.173282 g/mol |
| Enantiomer InChIKey | UVHGUYSARRYVMH-DBSXVDPOSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
1-Phenyl-3-(3,4,5-trimethoxy-phenyl)-[4,7]phenanthroline
3-Iodo-1-methyl-4-(2-nitrophenyl)-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
4-[(o-AMINOPHENYL)THIO]-N-[3,4-DIMETHOXYPHENETHYL)NAPHTHALIMIDE
N-(2-hydroxy-1,1-dimethylethyl)-2-methyl-5-{4-[4-(1-piperidinylcarbonyl)anilino]-1-phthalazinyl}benzenesulfonamide
2-Benzoyl-3-(p-methylphenyl)-4-[(p-tolyl)sulfonyl]-5-(methoxy)-2,3-dihydrofuran
Benzophenonetetracarboximido-bis(1,4-phenylene-9-fluorenediyl-1,4-phenylene-n-maleimide)
2-Amino-3-(1H-benzimidazol-2-yl)-7-methyl-5H-chromeno[2,3-b]pyridin-5-one
6-CYANO-9,10,11,11A-TETRAHYDRO-7H-BENZO-[DE]-PYRROLO-[2,1-A]-ISOQUINOLIN-9-ONE
(1R,14S,15R)-14,15-Dihydroxy-5,7-dioxa-12-azatetracyclo[10.5.2.0(2,10).0(4,8)]docosa-2,4(8),9-trien-13,17-dione
4-Carboxamido-9-methoxy-tetracyclo(5.4.0.0/2,4/.0/3,6/)undeca-1(7),8,10-triene
| Title | Journal or Book | Year |
|---|---|---|
| Design, Synthesis, and SAR of Tachykinin Antagonists: Modulation of Balance in NK1/NK2 Receptor Antagonist Activity | Journal of Medicinal Chemistry | 2002 |