| SpectraBase Spectrum ID |
4yGLpxq1lfx |
| Name |
2-Amino-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-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 © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H31N5O7S |
| InChI |
InChI=1S/C29H31N5O7S/c1-4-41-29(37)26-25(20-10-13-23(35)24(16-20)40-3)22(17-30)28(36)34(27(26)31)32-18(2)19-8-11-21(12-9-19)42(38,39)33-14-6-5-7-15-33/h8-13,16,35H,4-7,14-15,31H2,1-3H3/b32-18+ |
| InChIKey |
HJQVZASMLBXGSL-KCSSXMTESA-N |
| Molecular Weight |
593.655 g/mol |
| SMILES |
Oc1c(cc(C=2C(=C(N(C(C2C#N)=O)\N=C\(c2ccc(S(N3CCCCC3)(=O)=O)cc2)C)N)C(=O)OCC)cc1)OC |
| SPLASH |
splash10-001i-9000000000-2ddaff974dcd27bdd0f4 |
| Source of Spectrum |
F2-46-140-13 |
| Synonyms |
2-amino-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-6-oxo-1-[(E)-1-[4-(1-piperidinylsulfonyl)phenyl]ethylideneamino]-3-pyridinecarboxylic acid ethyl ester
ethyl 2-amino-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-6-oxo-1-[(E)-1-(4-piperidin-1-ylsulfonylphenyl)ethylideneamino]pyridine-3-carboxylate
ethyl 2-amino-5-cyano-4-(4-hydroxy-3-methoxy-phenyl)-6-oxo-1-[(E)-1-[4-(1-piperidylsulfonyl)phenyl]ethylideneamino]pyridine-3-carboxylate
ethyl 2-azanyl-5-cyano-4-(3-methoxy-4-oxidanyl-phenyl)-6-oxidanylidene-1-[(E)-1-(4-piperidin-1-ylsulfonylphenyl)ethylideneamino]pyridine-3-carboxylate |
| Wiley ID |
1690189 |
![2-Amino-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-6-oxo-1-{1-[4-(piperidine-1-sulfonyl)phenyl]ethylideneamino}-1,6-dihydropyridine-3-carboxylic acid ethyl ester](/api/spectrum/4yGLpxq1lfx/structure.png?h=300&w=458 "2-Amino-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-6-oxo-1-{1-[4-(piperidine-1-sulfonyl)phenyl]ethylideneamino}-1,6-dihydropyridine-3-carboxylic acid ethyl ester")
