6-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-cyano-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 6-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-cyano-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Openeye Name: 6-[2-(3-chloro-4-methyl-anilino)-2-oxo-ethyl]sulfanyl-5-cyano-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide CAS Name: 6-[[2-(3-chloro-4-methylanilino)-2-oxoethyl]thio]-5-cyano-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 6-[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl-5-cyano-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Traditional Name: 6-[[2-(3-chloro-4-methyl-anilino)-2-keto-ethyl]thio]-5-cyano-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide Formula: C27H23ClN4O2S2 MolecularWeight: 535.08012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=CS4)C#N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=CS4)C#N)Cl

InChI

InChI=1S/C27H23ClN4O2S2/c1-16-10-11-19(13-21(16)28)31-23(33)15-36-27-20(14-29)25(22-9-6-12-35-22)24(17(2)30-27)26(34)32-18-7-4-3-5-8-18/h3-13,25,30H,15H2,1-2H3,(H,31,33)(H,32,34)