methyl (4S)-6-methyl-4-(3-nitrophenyl)-2-[(1-phenylimidazol-2-yl)sulfanylmethylidene]-3,4-dihydro-1H-pyridine-5-carboxylate

Systemtic Name: methyl (4S)-6-methyl-4-(3-nitrophenyl)-2-[(1-phenylimidazol-2-yl)sulfanylmethylidene]-3,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: methyl (4S)-6-methyl-4-(3-nitrophenyl)-2-[(1-phenylimidazol-2-yl)sulfanylmethylene]-3,4-dihydro-1H-pyridine-5-carboxylate CAS Name: (4S)-6-methyl-4-(3-nitrophenyl)-2-[[(1-phenyl-2-imidazolyl)thio]methylidene]-3,4-dihydro-1H-pyridine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-6-methyl-4-(3-nitrophenyl)-2-[(1-phenylimidazol-2-yl)sulfanylmethylidene]-3,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: (4S)-6-methyl-4-(3-nitrophenyl)-2-[[(1-phenylimidazol-2-yl)thio]methylene]-3,4-dihydro-1H-pyridine-5-carboxylic acid methyl ester Formula: C24H22N4O4S MolecularWeight: 462.52088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(=CSC2=NC=CN2C3=CC=CC=C3)N1)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C([C@@H](CC(=CSC2=NC=CN2C3=CC=CC=C3)N1)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C24H22N4O4S/c1-16-22(23(29)32-2)21(17-7-6-10-20(13-17)28(30)31)14-18(26-16)15-33-24-25-11-12-27(24)19-8-4-3-5-9-19/h3-13,15,21,26H,14H2,1-2H3/t21-/m0/s1