N-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbothioyl]benzamide

Systemtic Name: N-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbothioyl]benzamide Openeye Name: N-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioyl)benzamide CAS Name: N-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-sulfanylidenemethyl]benzamide IUPAC Name: N-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioyl)benzamide Traditional Name: N-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioyl)benzamide Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=S)NC(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=S)NC(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C19H20N2O3S/c1-23-16-10-14-8-9-21(12-15(14)11-17(16)24-2)19(25)20-18(22)13-6-4-3-5-7-13/h3-7,10-11H,8-9,12H2,1-2H3,(H,20,22,25)