6,7-dimethoxy-2-methyl-4-(4-methylpiperazin-1-yl)carbonyl-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 6,7-dimethoxy-2-methyl-4-(4-methylpiperazin-1-yl)carbonyl-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethoxy-2-methyl-4-(4-methylpiperazine-1-carbonyl)-3-(2-thienyl)-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethoxy-2-methyl-4-[(4-methyl-1-piperazinyl)-oxomethyl]-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethoxy-2-methyl-4-(4-methylpiperazine-1-carbonyl)-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethoxy-2-methyl-4-(4-methylpiperazine-1-carbonyl)-3-(2-thienyl)-3,4-dihydroisocarbostyril Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2C(N(C(=O)C3=CC(=C(C=C23)OC)OC)C)C4=CC=CS4

Isomeric SMILES

CN1CCN(CC1)C(=O)C2C(N(C(=O)C3=CC(=C(C=C23)OC)OC)C)C4=CC=CS4

InChI

InChI=1S/C22H27N3O4S/c1-23-7-9-25(10-8-23)22(27)19-14-12-16(28-3)17(29-4)13-15(14)21(26)24(2)20(19)18-6-5-11-30-18/h5-6,11-13,19-20H,7-10H2,1-4H3