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

Systemtic Name: N-(2-ethylphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-(2-ethylphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-(2-ethylphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-(2-ethylphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-(2-ethylphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C20H24N2O2S/c1-4-14-7-5-6-8-17(14)21-20(25)22-10-9-15-11-18(23-2)19(24-3)12-16(15)13-22/h5-8,11-12H,4,9-10,13H2,1-3H3,(H,21,25)