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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33N3OS/c1-22(2,3)18-9-11-19(12-10-18)23-21(27)25-15-13-24(14-16-25)20(26)17-7-5-4-6-8-17/h9-12,17H,4-8,13-16H2,1-3H3,(H,23,27)