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

Systemtic Name: 2-azanyl-1-(dimethylamino)-4-(3-methyl-1-benzothiophen-2-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(dimethylamino)-4-(3-methylbenzothiophen-2-yl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(dimethylamino)-4-(3-methyl-1-benzothiophen-2-yl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(dimethylamino)-4-(3-methyl-1-benzothiophen-2-yl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-1-(dimethylamino)-5-keto-4-(3-methylbenzothiophen-2-yl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C3C(=C(N(C4=C3C(=O)CCC4)N(C)C)N)C#N

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C3C(=C(N(C4=C3C(=O)CCC4)N(C)C)N)C#N

InChI

InChI=1S/C21H22N4OS/c1-12-13-7-4-5-10-17(13)27-20(12)18-14(11-22)21(23)25(24(2)3)15-8-6-9-16(26)19(15)18/h4-5,7,10,18H,6,8-9,23H2,1-3H3