4-butyl-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-butyl-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide Openeye Name: 4-butyl-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide CAS Name: 4-butyl-N-(2,5-dimethylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-butyl-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide Traditional Name: 4-butyl-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide Formula: C17H27N3S MolecularWeight: 305.48138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C(=S)NC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCCCN1CCN(CC1)C(=S)NC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C17H27N3S/c1-4-5-8-19-9-11-20(12-10-19)17(21)18-16-13-14(2)6-7-15(16)3/h6-7,13H,4-5,8-12H2,1-3H3,(H,18,21)