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

Systemtic Name: 4-(3-cyclohexylpropanoylcarbamothioylamino)-N-(2-diethylaminoethyl)benzamide Openeye Name: 4-(3-cyclohexylpropanoylcarbamothioylamino)-N-(2-diethylaminoethyl)benzamide CAS Name: 4-[[[(3-cyclohexyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-N-(2-diethylaminoethyl)benzamide IUPAC Name: 4-(3-cyclohexylpropanoylcarbamothioylamino)-N-(2-diethylaminoethyl)benzamide Traditional Name: 4-(3-cyclohexylpropanoylthiocarbamoylamino)-N-(2-diethylaminoethyl)benzamide Formula: C23H36N4O2S MolecularWeight: 432.62254

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC2CCCCC2

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC2CCCCC2

InChI

InChI=1S/C23H36N4O2S/c1-3-27(4-2)17-16-24-22(29)19-11-13-20(14-12-19)25-23(30)26-21(28)15-10-18-8-6-5-7-9-18/h11-14,18H,3-10,15-17H2,1-2H3,(H,24,29)(H2,25,26,28,30)