2-[3-cyclohexylpropanoylcarbamothioyl(methyl)amino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[3-cyclohexylpropanoylcarbamothioyl(methyl)amino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[3-cyclohexylpropanoylcarbamothioyl(methyl)amino]benzamide CAS Name: 2-[[[(3-cyclohexyl-1-oxopropyl)amino]-sulfanylidenemethyl]-methylamino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[3-cyclohexylpropanoylcarbamothioyl(methyl)amino]benzamide Traditional Name: N-benzyl-2-[3-cyclohexylpropanoylthiocarbamoyl(methyl)amino]benzamide Formula: C25H31N3O2S MolecularWeight: 437.59754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NCC2=CC=CC=C2)C(=S)NC(=O)CCC3CCCCC3

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NCC2=CC=CC=C2)C(=S)NC(=O)CCC3CCCCC3

InChI

InChI=1S/C25H31N3O2S/c1-28(25(31)27-23(29)17-16-19-10-4-2-5-11-19)22-15-9-8-14-21(22)24(30)26-18-20-12-6-3-7-13-20/h3,6-9,12-15,19H,2,4-5,10-11,16-18H2,1H3,(H,26,30)(H,27,29,31)