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

Systemtic Name: 2-azanyl-4-(4-bromanyl-5-ethyl-thiophen-2-yl)-1-(4-methoxy-2-nitro-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-bromo-5-ethyl-2-thienyl)-1-(4-methoxy-2-nitro-phenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-bromo-5-ethyl-2-thiophenyl)-1-(4-methoxy-2-nitrophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromo-5-ethylthiophen-2-yl)-1-(4-methoxy-2-nitrophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-bromo-5-ethyl-2-thienyl)-5-keto-1-(4-methoxy-2-nitro-phenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C23H21BrN4O4S MolecularWeight: 529.40624

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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=C(C=C4)OC)[N+](=O)[O-])N)C#N)Br

Isomeric SMILES

CCC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=C(C=C4)OC)[N+](=O)[O-])N)C#N)Br

InChI

InChI=1S/C23H21BrN4O4S/c1-3-19-14(24)10-20(33-19)21-13(11-25)23(26)27(16-5-4-6-18(29)22(16)21)15-8-7-12(32-2)9-17(15)28(30)31/h7-10,21H,3-6,26H2,1-2H3