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

Systemtic Name: 2-azanyl-1-(4-chloranyl-2-nitro-phenyl)-4-(5-ethylthiophen-2-yl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(4-chloro-2-nitro-phenyl)-4-(5-ethyl-2-thienyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(4-chloro-2-nitrophenyl)-4-(5-ethyl-2-thiophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(4-chloro-2-nitrophenyl)-4-(5-ethylthiophen-2-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-(4-chloro-2-nitro-phenyl)-4-(5-ethyl-2-thienyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C24H23ClN4O3S MolecularWeight: 482.98242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=C(C=C(C=C4)Cl)[N+](=O)[O-])N)C#N

Isomeric SMILES

CCC1=CC=C(S1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=C(C=C(C=C4)Cl)[N+](=O)[O-])N)C#N

InChI

InChI=1S/C24H23ClN4O3S/c1-4-14-6-8-20(33-14)21-15(12-26)23(27)28(16-7-5-13(25)9-17(16)29(31)32)18-10-24(2,3)11-19(30)22(18)21/h5-9,21H,4,10-11,27H2,1-3H3