(4S)-2-azanyl-7,7-dimethyl-1-(4-nitrophenyl)-5-oxidanylidene-4-thiophen-3-yl-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: (4S)-2-azanyl-7,7-dimethyl-1-(4-nitrophenyl)-5-oxidanylidene-4-thiophen-3-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: (4S)-2-amino-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-4-(3-thienyl)-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: (4S)-2-amino-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-4-(3-thiophenyl)-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: (4S)-2-amino-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-4-thiophen-3-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: (4S)-2-amino-5-keto-7,7-dimethyl-1-(4-nitrophenyl)-4-(3-thienyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)[N+](=O)[O-])N)C#N)C4=CSC=C4)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C([C@H](C(=C(N2C3=CC=C(C=C3)[N+](=O)[O-])N)C#N)C4=CSC=C4)C(=O)C1)C

InChI

InChI=1S/C22H20N4O3S/c1-22(2)9-17-20(18(27)10-22)19(13-7-8-30-12-13)16(11-23)21(24)25(17)14-3-5-15(6-4-14)26(28)29/h3-8,12,19H,9-10,24H2,1-2H3/t19-/m0/s1