5-cyano-4-(3-methoxy-4-oxidanyl-phenyl)-2-methyl-6-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-N-phenyl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 5-cyano-4-(3-methoxy-4-oxidanyl-phenyl)-2-methyl-6-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Openeye Name: 6-[2-(benzylamino)-2-oxo-ethyl]sulfanyl-5-cyano-4-(4-hydroxy-3-methoxy-phenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-6-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]-N-phenyl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 6-[2-(benzylamino)-2-oxoethyl]sulfanyl-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Traditional Name: 6-[[2-(benzylamino)-2-keto-ethyl]thio]-5-cyano-4-(4-hydroxy-3-methoxy-phenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Formula: C30H28N4O4S MolecularWeight: 540.63272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)NCC2=CC=CC=C2)C#N)C3=CC(=C(C=C3)O)OC)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)NCC2=CC=CC=C2)C#N)C3=CC(=C(C=C3)O)OC)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C30H28N4O4S/c1-19-27(29(37)34-22-11-7-4-8-12-22)28(21-13-14-24(35)25(15-21)38-2)23(16-31)30(33-19)39-18-26(36)32-17-20-9-5-3-6-10-20/h3-15,28,33,35H,17-18H2,1-2H3,(H,32,36)(H,34,37)