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

Systemtic Name: 2-azanyl-1-(4-bromanyl-2-methyl-phenyl)-4-(5-ethylthiophen-2-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(4-bromo-2-methyl-phenyl)-4-(5-ethyl-2-thienyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(4-bromo-2-methylphenyl)-4-(5-ethyl-2-thiophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(4-bromo-2-methylphenyl)-4-(5-ethylthiophen-2-yl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-1-(4-bromo-2-methyl-phenyl)-4-(5-ethyl-2-thienyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C23H22BrN3OS MolecularWeight: 468.40928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22BrN3OS/c1-3-15-8-10-20(29-15)21-16(12-25)23(26)27(17-9-7-14(24)11-13(17)2)18-5-4-6-19(28)22(18)21/h7-11,21H,3-6,26H2,1-2H3