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

Systemtic Name: N-(2-cyanophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-(2-cyanophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-(2-cyanophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-(2-cyanophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-(2-cyanophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C17H15N3S MolecularWeight: 293.3861

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=S)NC3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=S)NC3=CC=CC=C3C#N

InChI

InChI=1S/C17H15N3S/c18-11-14-6-3-4-8-16(14)19-17(21)20-10-9-13-5-1-2-7-15(13)12-20/h1-8H,9-10,12H2,(H,19,21)