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

Systemtic Name: 3-[2-(4-chlorophenyl)ethanoylcarbamothioylamino]-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 3-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 3-[[[[2-(4-chlorophenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 3-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 3-[[2-(4-chlorophenyl)acetyl]thiocarbamoylamino]-N-(tetrahydrofurfuryl)benzamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClN3O3S/c22-16-8-6-14(7-9-16)11-19(26)25-21(29)24-17-4-1-3-15(12-17)20(27)23-13-18-5-2-10-28-18/h1,3-4,6-9,12,18H,2,5,10-11,13H2,(H,23,27)(H2,24,25,26,29)