4-(2-methylpiperidin-1-yl)benzenecarbothioamide

Systemtic Name: 4-(2-methylpiperidin-1-yl)benzenecarbothioamide Openeye Name: 4-(2-methyl-1-piperidyl)benzenecarbothioamide CAS Name: 4-(2-methyl-1-piperidinyl)benzenecarbothioamide IUPAC Name: 4-(2-methylpiperidin-1-yl)benzenecarbothioamide Traditional Name: 4-(2-methylpiperidino)thiobenzamide Formula: C13H18N2S MolecularWeight: 234.36042

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=CC=C(C=C2)C(=S)N

Isomeric SMILES

CC1CCCCN1C2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C13H18N2S/c1-10-4-2-3-9-15(10)12-7-5-11(6-8-12)13(14)16/h5-8,10H,2-4,9H2,1H3,(H2,14,16)