(4S)-1-(4-methyl-2-nitro-phenyl)-5-oxidanylidene-2-pyrrol-1-yl-4-thiophen-2-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: (4S)-1-(4-methyl-2-nitro-phenyl)-5-oxidanylidene-2-pyrrol-1-yl-4-thiophen-2-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: (4S)-1-(4-methyl-2-nitro-phenyl)-5-oxo-2-pyrrol-1-yl-4-(2-thienyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: (4S)-1-(4-methyl-2-nitrophenyl)-5-oxo-2-(1-pyrrolyl)-4-thiophen-2-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: (4S)-1-(4-methyl-2-nitrophenyl)-5-oxo-2-pyrrol-1-yl-4-thiophen-2-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: (4S)-5-keto-1-(4-methyl-2-nitro-phenyl)-2-pyrrol-1-yl-4-(2-thienyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C25H20N4O3S MolecularWeight: 456.5163

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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=CC=CS5)C(=O)CCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)N2C3=C([C@H](C(=C2N4C=CC=C4)C#N)C5=CC=CS5)C(=O)CCC3)[N+](=O)[O-]

InChI

InChI=1S/C25H20N4O3S/c1-16-9-10-18(20(14-16)29(31)32)28-19-6-4-7-21(30)24(19)23(22-8-5-13-33-22)17(15-26)25(28)27-11-2-3-12-27/h2-3,5,8-14,23H,4,6-7H2,1H3/t23-/m1/s1