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

Systemtic Name: 2-azanyl-1-(4-chloranyl-3-nitro-phenyl)-7,7-dimethyl-4-(5-methylthiophen-2-yl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(4-chloro-3-nitro-phenyl)-7,7-dimethyl-4-(5-methyl-2-thienyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(4-chloro-3-nitrophenyl)-7,7-dimethyl-4-(5-methyl-2-thiophenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(4-chloro-3-nitrophenyl)-7,7-dimethyl-4-(5-methylthiophen-2-yl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-(4-chloro-3-nitro-phenyl)-5-keto-7,7-dimethyl-4-(5-methyl-2-thienyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C23H21ClN4O3S MolecularWeight: 468.95584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])N)C#N

Isomeric SMILES

CC1=CC=C(S1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])N)C#N

InChI

InChI=1S/C23H21ClN4O3S/c1-12-4-7-19(32-12)20-14(11-25)22(26)27(13-5-6-15(24)16(8-13)28(30)31)17-9-23(2,3)10-18(29)21(17)20/h4-8,20H,9-10,26H2,1-3H3