(4S)-6-[2-(3-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-5-cyano-4-(furan-2-yl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide

Systemtic Name: (4S)-6-[2-(3-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-5-cyano-4-(furan-2-yl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide Openeye Name: (4S)-6-[2-(3-bromophenyl)-2-oxo-ethyl]sulfanyl-5-cyano-4-(2-furyl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide CAS Name: (4S)-6-[[2-(3-bromophenyl)-2-oxoethyl]thio]-5-cyano-4-(2-furanyl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide IUPAC Name: (4S)-6-[2-(3-bromophenyl)-2-oxoethyl]sulfanyl-5-cyano-4-(furan-2-yl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide Traditional Name: (4S)-6-[[2-(3-bromophenyl)-2-keto-ethyl]thio]-5-cyano-4-(2-furyl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide Formula: C26H20BrN3O3S MolecularWeight: 534.4243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)NC2=CC=CC=C2)C3=CC=CO3)C#N)SCC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=NC(=C([C@H](C1C(=O)NC2=CC=CC=C2)C3=CC=CO3)C#N)SCC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C26H20BrN3O3S/c1-16-23(25(32)30-19-9-3-2-4-10-19)24(22-11-6-12-33-22)20(14-28)26(29-16)34-15-21(31)17-7-5-8-18(27)13-17/h2-13,23-24H,15H2,1H3,(H,30,32)/t23?,24-/m0/s1