4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-N-(2-diethylaminoethyl)benzamide

Systemtic Name: 4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-N-(2-diethylaminoethyl)benzamide Openeye Name: 4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-N-(2-diethylaminoethyl)benzamide CAS Name: 4-[[[[3-(2-chlorophenyl)-1-oxopropyl]amino]-sulfanylidenemethyl]amino]-N-(2-diethylaminoethyl)benzamide IUPAC Name: 4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-N-(2-diethylaminoethyl)benzamide Traditional Name: 4-[3-(2-chlorophenyl)propanoylthiocarbamoylamino]-N-(2-diethylaminoethyl)benzamide Formula: C23H29ClN4O2S MolecularWeight: 461.01996

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC2=CC=CC=C2Cl

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC2=CC=CC=C2Cl

InChI

InChI=1S/C23H29ClN4O2S/c1-3-28(4-2)16-15-25-22(30)18-9-12-19(13-10-18)26-23(31)27-21(29)14-11-17-7-5-6-8-20(17)24/h5-10,12-13H,3-4,11,14-16H2,1-2H3,(H,25,30)(H2,26,27,29,31)