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

Systemtic Name: 2-azanyl-1-(dimethylamino)-4-(3-methyl-1-benzothiophen-2-yl)-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(dimethylamino)-4-(3-methylbenzothiophen-2-yl)-5-oxo-7-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(dimethylamino)-4-(3-methyl-1-benzothiophen-2-yl)-5-oxo-7-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(dimethylamino)-4-(3-methyl-1-benzothiophen-2-yl)-5-oxo-7-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-1-(dimethylamino)-5-keto-4-(3-methylbenzothiophen-2-yl)-7-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C27H26N4OS MolecularWeight: 454.58654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C3C(=C(N(C4=C3C(=O)CC(C4)C5=CC=CC=C5)N(C)C)N)C#N

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C3C(=C(N(C4=C3C(=O)CC(C4)C5=CC=CC=C5)N(C)C)N)C#N

InChI

InChI=1S/C27H26N4OS/c1-16-19-11-7-8-12-23(19)33-26(16)24-20(15-28)27(29)31(30(2)3)21-13-18(14-22(32)25(21)24)17-9-5-4-6-10-17/h4-12,18,24H,13-14,29H2,1-3H3