| SpectraBase Spectrum ID |
HU1Ijk06ERu |
| Name |
2-Amino-5-cyano-4-(4-chlorophenyl)-6-oxo-1-{1-[4-(piperidine-1-sulfonyl)phenyl]ethylideneamino}-1,6-dihydropyridine-3-carboxylic acid ethyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H28ClN5O5S |
| InChI |
InChI=1S/C28H28ClN5O5S/c1-3-39-28(36)25-24(20-7-11-21(29)12-8-20)23(17-30)27(35)34(26(25)31)32-18(2)19-9-13-22(14-10-19)40(37,38)33-15-5-4-6-16-33/h7-14H,3-6,15-16,31H2,1-2H3/b32-18+ |
| InChIKey |
NVDRJOTZACGFNO-KCSSXMTESA-N |
| Molecular Weight |
582.075 g/mol |
| SMILES |
NC1=C(C(=O)OCC)C(=C(C(N1\N=C\(c1ccc(S(N2CCCCC2)(=O)=O)cc1)C)=O)C#N)c1ccc(cc1)Cl |
| SPLASH |
splash10-001i-9000000000-1a106c28c21fc99fc6fd |
| Source of Spectrum |
F2-46-140-15 |
| Synonyms |
2-amino-4-(4-chlorophenyl)-5-cyano-6-oxo-1-[(E)-1-[4-(1-piperidinylsulfonyl)phenyl]ethylideneamino]-3-pyridinecarboxylic acid ethyl ester
ethyl 2-amino-4-(4-chlorophenyl)-5-cyano-6-oxo-1-[(E)-1-(4-piperidin-1-ylsulfonylphenyl)ethylideneamino]pyridine-3-carboxylate
ethyl 2-amino-4-(4-chlorophenyl)-5-cyano-6-oxo-1-[(E)-1-[4-(1-piperidylsulfonyl)phenyl]ethylideneamino]pyridine-3-carboxylate
ethyl 2-azanyl-4-(4-chlorophenyl)-5-cyano-6-oxidanylidene-1-[(E)-1-(4-piperidin-1-ylsulfonylphenyl)ethylideneamino]pyridine-3-carboxylate |
| Wiley ID |
1690187 |
![2-Amino-5-cyano-4-(4-chlorophenyl)-6-oxo-1-{1-[4-(piperidine-1-sulfonyl)phenyl]ethylideneamino}-1,6-dihydropyridine-3-carboxylic acid ethyl ester](/api/spectrum/HU1Ijk06ERu/structure.png?h=300&w=458 "2-Amino-5-cyano-4-(4-chlorophenyl)-6-oxo-1-{1-[4-(piperidine-1-sulfonyl)phenyl]ethylideneamino}-1,6-dihydropyridine-3-carboxylic acid ethyl ester")
