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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)N2CCC3=CC=CC=C3C2

InChI

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