N-(3,5-dimethylphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: N-(3,5-dimethylphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-(3,5-dimethylphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-(3,5-dimethylphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-(3,5-dimethylphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-(3,5-dimethylphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C18H20N2S MolecularWeight: 296.4298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N2CCC3=CC=CC=C3C2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N2CCC3=CC=CC=C3C2)C

InChI

InChI=1S/C18H20N2S/c1-13-9-14(2)11-17(10-13)19-18(21)20-8-7-15-5-3-4-6-16(15)12-20/h3-6,9-11H,7-8,12H2,1-2H3,(H,19,21)