(4R)-5,8-dimethoxy-N-(3-methylphenyl)-4-oxidanyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: (4R)-5,8-dimethoxy-N-(3-methylphenyl)-4-oxidanyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: (4R)-4-hydroxy-5,8-dimethoxy-N-(m-tolyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: (4R)-4-hydroxy-5,8-dimethoxy-N-(3-methylphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: (4R)-4-hydroxy-5,8-dimethoxy-N-(3-methylphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: (4R)-4-hydroxy-5,8-dimethoxy-N-(m-tolyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N2CC(C3=C(C=CC(=C3C2)OC)OC)O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N2C[C@@H](C3=C(C=CC(=C3C2)OC)OC)O

InChI

InChI=1S/C19H22N2O3S/c1-12-5-4-6-13(9-12)20-19(25)21-10-14-16(23-2)7-8-17(24-3)18(14)15(22)11-21/h4-9,15,22H,10-11H2,1-3H3,(H,20,25)/t15-/m0/s1