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

Systemtic Name: 2-[3-cyclohexylpropanoylcarbamothioyl(methyl)amino]-N-phenethyl-benzamide Openeye Name: 2-[3-cyclohexylpropanoylcarbamothioyl(methyl)amino]-N-phenethyl-benzamide CAS Name: 2-[[[(3-cyclohexyl-1-oxopropyl)amino]-sulfanylidenemethyl]-methylamino]-N-phenethylbenzamide IUPAC Name: 2-[3-cyclohexylpropanoylcarbamothioyl(methyl)amino]-N-phenethylbenzamide Traditional Name: 2-[3-cyclohexylpropanoylthiocarbamoyl(methyl)amino]-N-phenethyl-benzamide Formula: C26H33N3O2S MolecularWeight: 451.62412

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NCCC2=CC=CC=C2)C(=S)NC(=O)CCC3CCCCC3

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NCCC2=CC=CC=C2)C(=S)NC(=O)CCC3CCCCC3

InChI

InChI=1S/C26H33N3O2S/c1-29(26(32)28-24(30)17-16-20-10-4-2-5-11-20)23-15-9-8-14-22(23)25(31)27-19-18-21-12-6-3-7-13-21/h3,6-9,12-15,20H,2,4-5,10-11,16-19H2,1H3,(H,27,31)(H,28,30,32)