4-[2-(4-chlorophenyl)ethanoylcarbamothioylamino]-N-(3-methoxypropyl)benzamide

Systemtic Name: 4-[2-(4-chlorophenyl)ethanoylcarbamothioylamino]-N-(3-methoxypropyl)benzamide Openeye Name: 4-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-N-(3-methoxypropyl)benzamide CAS Name: 4-[[[[2-(4-chlorophenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-N-(3-methoxypropyl)benzamide IUPAC Name: 4-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-N-(3-methoxypropyl)benzamide Traditional Name: 4-[[2-(4-chlorophenyl)acetyl]thiocarbamoylamino]-N-(3-methoxypropyl)benzamide Formula: C20H22ClN3O3S MolecularWeight: 419.92498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O3S/c1-27-12-2-11-22-19(26)15-5-9-17(10-6-15)23-20(28)24-18(25)13-14-3-7-16(21)8-4-14/h3-10H,2,11-13H2,1H3,(H,22,26)(H2,23,24,25,28)