4-cyclohexylcarbonyl-N-(2-methoxy-5-methyl-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-cyclohexylcarbonyl-N-(2-methoxy-5-methyl-phenyl)piperazine-1-carbothioamide Openeye Name: 4-(cyclohexanecarbonyl)-N-(2-methoxy-5-methyl-phenyl)piperazine-1-carbothioamide CAS Name: 4-[cyclohexyl(oxo)methyl]-N-(2-methoxy-5-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(cyclohexanecarbonyl)-N-(2-methoxy-5-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(cyclohexanecarbonyl)-N-(2-methoxy-5-methyl-phenyl)piperazine-1-carbothioamide Formula: C20H29N3O2S MolecularWeight: 375.52816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)N2CCN(CC2)C(=O)C3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)N2CCN(CC2)C(=O)C3CCCCC3

InChI

InChI=1S/C20H29N3O2S/c1-15-8-9-18(25-2)17(14-15)21-20(26)23-12-10-22(11-13-23)19(24)16-6-4-3-5-7-16/h8-9,14,16H,3-7,10-13H2,1-2H3,(H,21,26)