N-(3-chloranyl-2-methyl-phenyl)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)ethanethioamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)ethanethioamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)thioacetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)ethanethioamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)ethanethioamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)thioacetamide Formula: C20H21ClN2O2S MolecularWeight: 388.91094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)CC2=NCCC3=CC(=C(C=C32)OC)OC

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)CC2=NCCC3=CC(=C(C=C32)OC)OC

InChI

InChI=1S/C20H21ClN2O2S/c1-12-15(21)5-4-6-16(12)23-20(26)11-17-14-10-19(25-3)18(24-2)9-13(14)7-8-22-17/h4-6,9-10H,7-8,11H2,1-3H3,(H,23,26)