(1R)-N-cyclopropyl-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: (1R)-N-cyclopropyl-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: (1R)-N-cyclopropyl-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: (1R)-N-cyclopropyl-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: (1R)-N-cyclopropyl-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: (1R)-N-cyclopropyl-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C3=CC(=C(C=C3CCN2C(=S)NC4CC4)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2C3=CC(=C(C=C3CCN2C(=S)NC4CC4)OC)OC)OC

InChI

InChI=1S/C23H28N2O4S/c1-26-18-8-5-15(12-19(18)27-2)22-17-13-21(29-4)20(28-3)11-14(17)9-10-25(22)23(30)24-16-6-7-16/h5,8,11-13,16,22H,6-7,9-10H2,1-4H3,(H,24,30)/t22-/m1/s1