6-[2-[(3-bromophenyl)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-bromophenyl)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-bromoanilino)-2-oxo-ethyl]sulfanyl-5-cyano-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide CAS Name: 6-[[2-(3-bromoanilino)-2-oxoethyl]thio]-5-cyano-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 6-[2-(3-bromoanilino)-2-oxoethyl]sulfanyl-5-cyano-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Traditional Name: 6-[[2-(3-bromoanilino)-2-keto-ethyl]thio]-5-cyano-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide Formula: C26H21BrN4O2S2 MolecularWeight: 565.50454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC(=CC=C2)Br)C#N)C3=CC=CS3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC(=CC=C2)Br)C#N)C3=CC=CS3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H21BrN4O2S2/c1-16-23(25(33)31-18-8-3-2-4-9-18)24(21-11-6-12-34-21)20(14-28)26(29-16)35-15-22(32)30-19-10-5-7-17(27)13-19/h2-13,24,29H,15H2,1H3,(H,30,32)(H,31,33)