2-(3-cyclohexylpropanoylcarbamothioylamino)-N-(4-ethoxyphenyl)benzamide

Systemtic Name: 2-(3-cyclohexylpropanoylcarbamothioylamino)-N-(4-ethoxyphenyl)benzamide Openeye Name: 2-(3-cyclohexylpropanoylcarbamothioylamino)-N-(4-ethoxyphenyl)benzamide CAS Name: 2-[[[(3-cyclohexyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-N-(4-ethoxyphenyl)benzamide IUPAC Name: 2-(3-cyclohexylpropanoylcarbamothioylamino)-N-(4-ethoxyphenyl)benzamide Traditional Name: 2-(3-cyclohexylpropanoylthiocarbamoylamino)-N-p-phenetyl-benzamide Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)CCC3CCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)CCC3CCCCC3

InChI

InChI=1S/C25H31N3O3S/c1-2-31-20-15-13-19(14-16-20)26-24(30)21-10-6-7-11-22(21)27-25(32)28-23(29)17-12-18-8-4-3-5-9-18/h6-7,10-11,13-16,18H,2-5,8-9,12,17H2,1H3,(H,26,30)(H2,27,28,29,32)