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ethyl 6-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-(4-chlorophenyl)-5-cyano-2-oxidanyl-2-phenyl-3,4-dihydro-1H-pyridine-3-carboxylate

ethyl 6-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-(4-chlorophenyl)-5-cyano-2-oxidanyl-2-phenyl-3,4-dihydro-1H-pyridine-3-carboxylate

Systemtic Name:ethyl 6-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-(4-chlorophenyl)-5-cyano-2-oxidanyl-2-phenyl-3,4-dihydro-1H-pyridine-3-carboxylate
Openeye Name:ethyl 6-(2-amino-2-oxo-ethyl)sulfanyl-4-(4-chlorophenyl)-5-cyano-2-hydroxy-2-phenyl-3,4-dihydro-1H-pyridine-3-carboxylate
CAS Name:6-[(2-amino-2-oxoethyl)thio]-4-(4-chlorophenyl)-5-cyano-2-hydroxy-2-phenyl-3,4-dihydro-1H-pyridine-3-carboxylic acid ethyl ester
IUPAC Name:ethyl 6-(2-amino-2-oxoethyl)sulfanyl-4-(4-chlorophenyl)-5-cyano-2-hydroxy-2-phenyl-3,4-dihydro-1H-pyridine-3-carboxylate
Traditional Name:6-[(2-amino-2-keto-ethyl)thio]-4-(4-chlorophenyl)-5-cyano-2-hydroxy-2-phenyl-3,4-dihydro-1H-pyridine-3-carboxylic acid ethyl ester
Formula: C23H22ClN3O4S
MolecularWeight: 471.95648
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=C(NC1(C2=CC=CC=C2)O)SCC(=O)N)C#N)C3=CC=C(C=C3)Cl


Isomeric SMILES

CCOC(=O)C1C(C(=C(NC1(C2=CC=CC=C2)O)SCC(=O)N)C#N)C3=CC=C(C=C3)Cl


InChI

InChI=1S/C23H22ClN3O4S/c1-2-31-22(29)20-19(14-8-10-16(24)11-9-14)17(12-25)21(32-13-18(26)28)27-23(20,30)15-6-4-3-5-7-15/h3-11,19-20,27,30H,2,13H2,1H3,(H2,26,28)


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