4-[butan-2-yl(methyl)amino]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide

Systemtic Name: 4-[butan-2-yl(methyl)amino]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide Openeye Name: 4-[methyl(sec-butyl)amino]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide CAS Name: 4-[butan-2-yl(methyl)amino]-N-[3-(methylthio)phenyl]-1-piperidinecarbothioamide IUPAC Name: 4-[butan-2-yl(methyl)amino]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide Traditional Name: 4-[methyl(sec-butyl)amino]-N-[3-(methylthio)phenyl]piperidine-1-carbothioamide Formula: C18H29N3S2 MolecularWeight: 351.57296

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C)C1CCN(CC1)C(=S)NC2=CC(=CC=C2)SC

Isomeric SMILES

CCC(C)N(C)C1CCN(CC1)C(=S)NC2=CC(=CC=C2)SC

InChI

InChI=1S/C18H29N3S2/c1-5-14(2)20(3)16-9-11-21(12-10-16)18(22)19-15-7-6-8-17(13-15)23-4/h6-8,13-14,16H,5,9-12H2,1-4H3,(H,19,22)