N-[1-[(3-acetamidophenyl)carbamothioylamino]-2,2,2-tris(chloranyl)ethyl]-3-methoxy-benzamide

Systemtic Name: N-[1-[(3-acetamidophenyl)carbamothioylamino]-2,2,2-tris(chloranyl)ethyl]-3-methoxy-benzamide Openeye Name: N-[1-[(3-acetamidophenyl)carbamothioylamino]-2,2,2-trichloro-ethyl]-3-methoxy-benzamide CAS Name: N-[1-[[(3-acetamidoanilino)-sulfanylidenemethyl]amino]-2,2,2-trichloroethyl]-3-methoxybenzamide IUPAC Name: N-[1-[(3-acetamidophenyl)carbamothioylamino]-2,2,2-trichloroethyl]-3-methoxybenzamide Traditional Name: N-[1-[(3-acetamidophenyl)thiocarbamoylamino]-2,2,2-trichloro-ethyl]-3-methoxy-benzamide Formula: C19H19Cl3N4O3S MolecularWeight: 489.80316

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC(=CC=C2)OC

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC(=CC=C2)OC

InChI

InChI=1S/C19H19Cl3N4O3S/c1-11(27)23-13-6-4-7-14(10-13)24-18(30)26-17(19(20,21)22)25-16(28)12-5-3-8-15(9-12)29-2/h3-10,17H,1-2H3,(H,23,27)(H,25,28)(H2,24,26,30)