N-[(4-chlorophenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-[(4-chlorophenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-[(4-chlorophenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-[(4-chlorophenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-(4-chlorobenzyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C17H17ClN2S MolecularWeight: 316.84828

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=S)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=S)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H17ClN2S/c18-16-7-5-13(6-8-16)11-19-17(21)20-10-9-14-3-1-2-4-15(14)12-20/h1-8H,9-12H2,(H,19,21)