N-(4-butan-2-ylphenyl)-4-methyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-butan-2-ylphenyl)-4-methyl-piperazine-1-carbothioamide Openeye Name: 4-methyl-N-(4-sec-butylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butan-2-ylphenyl)-4-methyl-1-piperazinecarbothioamide IUPAC Name: N-(4-butan-2-ylphenyl)-4-methylpiperazine-1-carbothioamide Traditional Name: 4-methyl-N-(4-sec-butylphenyl)piperazine-1-carbothioamide Formula: C16H25N3S MolecularWeight: 291.4548

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C

InChI

InChI=1S/C16H25N3S/c1-4-13(2)14-5-7-15(8-6-14)17-16(20)19-11-9-18(3)10-12-19/h5-8,13H,4,9-12H2,1-3H3,(H,17,20)