4-[[butyl(methyl)amino]methyl]benzenecarbothioamide

Systemtic Name: 4-[[butyl(methyl)amino]methyl]benzenecarbothioamide Openeye Name: 4-[[butyl(methyl)amino]methyl]benzenecarbothioamide CAS Name: 4-[[butyl(methyl)amino]methyl]benzenecarbothioamide IUPAC Name: 4-[[butyl(methyl)amino]methyl]benzenecarbothioamide Traditional Name: 4-[[butyl(methyl)amino]methyl]thiobenzamide Formula: C13H20N2S MolecularWeight: 236.3763

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)CC1=CC=C(C=C1)C(=S)N

Isomeric SMILES

CCCCN(C)CC1=CC=C(C=C1)C(=S)N

InChI

InChI=1S/C13H20N2S/c1-3-4-9-15(2)10-11-5-7-12(8-6-11)13(14)16/h5-8H,3-4,9-10H2,1-2H3,(H2,14,16)