N-butyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: N-butyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-butyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-butyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-butyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-butyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C14H20N2S MolecularWeight: 248.387

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CCC2=CC=CC=C2C1

Isomeric SMILES

CCCCNC(=S)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C14H20N2S/c1-2-3-9-15-14(17)16-10-8-12-6-4-5-7-13(12)11-16/h4-7H,2-3,8-11H2,1H3,(H,15,17)