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

Systemtic Name: N-(3-methylsulfanylpropyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-(3-methylsulfanylpropyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-[3-(methylthio)propyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-(3-methylsulfanylpropyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-[3-(methylthio)propyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C14H20N2S2 MolecularWeight: 280.452

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)N1CCC2=CC=CC=C2C1

Isomeric SMILES

CSCCCNC(=S)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C14H20N2S2/c1-18-10-4-8-15-14(17)16-9-7-12-5-2-3-6-13(12)11-16/h2-3,5-6H,4,7-11H2,1H3,(H,15,17)