4-[2-(4-chlorophenyl)ethanoylcarbamothioylamino]-N-(2-diethylaminoethyl)benzamide

Systemtic Name: 4-[2-(4-chlorophenyl)ethanoylcarbamothioylamino]-N-(2-diethylaminoethyl)benzamide Openeye Name: 4-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-N-(2-diethylaminoethyl)benzamide CAS Name: 4-[[[[2-(4-chlorophenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-N-(2-diethylaminoethyl)benzamide IUPAC Name: 4-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-N-(2-diethylaminoethyl)benzamide Traditional Name: 4-[[2-(4-chlorophenyl)acetyl]thiocarbamoylamino]-N-(2-diethylaminoethyl)benzamide Formula: C22H27ClN4O2S MolecularWeight: 446.99338

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H27ClN4O2S/c1-3-27(4-2)14-13-24-21(29)17-7-11-19(12-8-17)25-22(30)26-20(28)15-16-5-9-18(23)10-6-16/h5-12H,3-4,13-15H2,1-2H3,(H,24,29)(H2,25,26,28,30)