(4S)-7,7-dimethyl-1-(4-methyl-2-nitro-phenyl)-4-(3-methylthiophen-2-yl)-5-oxidanylidene-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: (4S)-7,7-dimethyl-1-(4-methyl-2-nitro-phenyl)-4-(3-methylthiophen-2-yl)-5-oxidanylidene-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: (4S)-7,7-dimethyl-1-(4-methyl-2-nitro-phenyl)-4-(3-methyl-2-thienyl)-5-oxo-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: (4S)-7,7-dimethyl-1-(4-methyl-2-nitrophenyl)-4-(3-methyl-2-thiophenyl)-5-oxo-2-(1-pyrrolyl)-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: (4S)-7,7-dimethyl-1-(4-methyl-2-nitrophenyl)-4-(3-methylthiophen-2-yl)-5-oxo-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: (4S)-5-keto-7,7-dimethyl-1-(4-methyl-2-nitro-phenyl)-4-(3-methyl-2-thienyl)-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C28H26N4O3S MolecularWeight: 498.59604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C3=C(C(C(=C2N4C=CC=C4)C#N)C5=C(C=CS5)C)C(=O)CC(C3)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)N2C3=C([C@H](C(=C2N4C=CC=C4)C#N)C5=C(C=CS5)C)C(=O)CC(C3)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C28H26N4O3S/c1-17-7-8-20(21(13-17)32(34)35)31-22-14-28(3,4)15-23(33)25(22)24(26-18(2)9-12-36-26)19(16-29)27(31)30-10-5-6-11-30/h5-13,24H,14-15H2,1-4H3/t24-/m0/s1