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

Systemtic Name: (1R)-6,7-dimethoxy-N-(3-methoxyphenyl)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: (1R)-6,7-dimethoxy-N-(3-methoxyphenyl)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: (1R)-6,7-dimethoxy-N-(3-methoxyphenyl)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: (1R)-6,7-dimethoxy-N-(3-methoxyphenyl)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: (1R)-6,7-dimethoxy-N-(3-methoxyphenyl)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCC3=CC(=C(C=C3C2C4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCC3=CC(=C(C=C3[C@H]2C4=CC=CC=C4)OC)OC

InChI

InChI=1S/C25H26N2O3S/c1-28-20-11-7-10-19(15-20)26-25(31)27-13-12-18-14-22(29-2)23(30-3)16-21(18)24(27)17-8-5-4-6-9-17/h4-11,14-16,24H,12-13H2,1-3H3,(H,26,31)/t24-/m1/s1