N3,N5-bis(4-bromophenyl)-2,6-dimethyl-4-(2-methylsulfanyl-3-phenylazanyl-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxamide

Systemtic Name: N3,N5-bis(4-bromophenyl)-2,6-dimethyl-4-(2-methylsulfanyl-3-phenylazanyl-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxamide Openeye Name: 4-(3-anilino-2-methylsulfanyl-imidazol-4-yl)-N3,N5-bis(4-bromophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxamide CAS Name: 4-[3-anilino-2-(methylthio)-4-imidazolyl]-N3,N5-bis(4-bromophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxamide IUPAC Name: 4-(3-anilino-2-methylsulfanylimidazol-4-yl)-3-N,5-N-bis(4-bromophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxamide Traditional Name: 4-[3-anilino-2-(methylthio)imidazol-4-yl]-N,N'-bis(4-bromophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxamide Formula: C31H28Br2N6O2S MolecularWeight: 708.46602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)NC2=CC=C(C=C2)Br)C3=CN=C(N3NC4=CC=CC=C4)SC)C(=O)NC5=CC=C(C=C5)Br

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)NC2=CC=C(C=C2)Br)C3=CN=C(N3NC4=CC=CC=C4)SC)C(=O)NC5=CC=C(C=C5)Br

InChI

InChI=1S/C31H28Br2N6O2S/c1-18-26(29(40)36-22-13-9-20(32)10-14-22)28(25-17-34-31(42-3)39(25)38-24-7-5-4-6-8-24)27(19(2)35-18)30(41)37-23-15-11-21(33)12-16-23/h4-17,28,35,38H,1-3H3,(H,36,40)(H,37,41)