(1S)-1-(2-fluorophenyl)-6,7-dimethoxy-N-methyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: (1S)-1-(2-fluorophenyl)-6,7-dimethoxy-N-methyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: (1S)-1-(2-fluorophenyl)-6,7-dimethoxy-N-methyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: (1S)-1-(2-fluorophenyl)-6,7-dimethoxy-N-methyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: (1S)-1-(2-fluorophenyl)-6,7-dimethoxy-N-methyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: (1S)-1-(2-fluorophenyl)-6,7-dimethoxy-N-methyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C19H21FN2O2S MolecularWeight: 360.445643

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1CCC2=CC(=C(C=C2C1C3=CC=CC=C3F)OC)OC

Isomeric SMILES

CNC(=S)N1CCC2=CC(=C(C=C2[C@H]1C3=CC=CC=C3F)OC)OC

InChI

InChI=1S/C19H21FN2O2S/c1-21-19(25)22-9-8-12-10-16(23-2)17(24-3)11-14(12)18(22)13-6-4-5-7-15(13)20/h4-7,10-11,18H,8-9H2,1-3H3,(H,21,25)/t18-/m1/s1