2-azanyl-4-(4-bromanyl-5-ethyl-thiophen-2-yl)-1-(5-chloranyl-2-methyl-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-bromanyl-5-ethyl-thiophen-2-yl)-1-(5-chloranyl-2-methyl-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-bromo-5-ethyl-2-thienyl)-1-(5-chloro-2-methyl-phenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-bromo-5-ethyl-2-thiophenyl)-1-(5-chloro-2-methylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromo-5-ethylthiophen-2-yl)-1-(5-chloro-2-methylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-bromo-5-ethyl-2-thienyl)-1-(5-chloro-2-methyl-phenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C23H21BrClN3OS MolecularWeight: 502.85434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=CC(=C4)Cl)C)N)C#N)Br

Isomeric SMILES

CCC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=CC(=C4)Cl)C)N)C#N)Br

InChI

InChI=1S/C23H21BrClN3OS/c1-3-19-15(24)10-20(30-19)21-14(11-26)23(27)28(16-5-4-6-18(29)22(16)21)17-9-13(25)8-7-12(17)2/h7-10,21H,3-6,27H2,1-2H3