N-hexyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: N-hexyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-hexyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-hexyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-hexyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-hexyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C18H28N2O2S MolecularWeight: 336.49212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=S)N1CCC2=CC(=C(C=C2C1)OC)OC

Isomeric SMILES

CCCCCCNC(=S)N1CCC2=CC(=C(C=C2C1)OC)OC

InChI

InChI=1S/C18H28N2O2S/c1-4-5-6-7-9-19-18(23)20-10-8-14-11-16(21-2)17(22-3)12-15(14)13-20/h11-12H,4-10,13H2,1-3H3,(H,19,23)