N-(4-butylphenyl)-4-cyclohexylcarbonyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-butylphenyl)-4-cyclohexylcarbonyl-piperazine-1-carbothioamide Openeye Name: N-(4-butylphenyl)-4-(cyclohexanecarbonyl)piperazine-1-carbothioamide CAS Name: N-(4-butylphenyl)-4-[cyclohexyl(oxo)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(4-butylphenyl)-4-(cyclohexanecarbonyl)piperazine-1-carbothioamide Traditional Name: N-(4-butylphenyl)-4-(cyclohexanecarbonyl)piperazine-1-carbothioamide Formula: C22H33N3OS MolecularWeight: 387.58192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3CCCCC3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3CCCCC3

InChI

InChI=1S/C22H33N3OS/c1-2-3-7-18-10-12-20(13-11-18)23-22(27)25-16-14-24(15-17-25)21(26)19-8-5-4-6-9-19/h10-13,19H,2-9,14-17H2,1H3,(H,23,27)