N-[4-[(4-acetamidophenyl)carbamothioylamino]-2-chloranyl-phenyl]benzamide

Systemtic Name: N-[4-[(4-acetamidophenyl)carbamothioylamino]-2-chloranyl-phenyl]benzamide Openeye Name: N-[4-[(4-acetamidophenyl)carbamothioylamino]-2-chloro-phenyl]benzamide CAS Name: N-[4-[[(4-acetamidoanilino)-sulfanylidenemethyl]amino]-2-chlorophenyl]benzamide IUPAC Name: N-[4-[(4-acetamidophenyl)carbamothioylamino]-2-chlorophenyl]benzamide Traditional Name: N-[4-[(4-acetamidophenyl)thiocarbamoylamino]-2-chloro-phenyl]benzamide Formula: C22H19ClN4O2S MolecularWeight: 438.92986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C22H19ClN4O2S/c1-14(28)24-16-7-9-17(10-8-16)25-22(30)26-18-11-12-20(19(23)13-18)27-21(29)15-5-3-2-4-6-15/h2-13H,1H3,(H,24,28)(H,27,29)(H2,25,26,30)