2,4-bis(chloranyl)-N-[3-[(4-methylphenyl)carbonylcarbamothioylamino]phenyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[3-[(4-methylphenyl)carbonylcarbamothioylamino]phenyl]benzamide Openeye Name: 2,4-dichloro-N-[3-[(4-methylbenzoyl)carbamothioylamino]phenyl]benzamide CAS Name: 2,4-dichloro-N-[3-[[[[(4-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 2,4-dichloro-N-[3-[(4-methylbenzoyl)carbamothioylamino]phenyl]benzamide Traditional Name: 2,4-dichloro-N-[3-(p-toluoylthiocarbamoylamino)phenyl]benzamide Formula: C22H17Cl2N3O2S MolecularWeight: 458.36028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H17Cl2N3O2S/c1-13-5-7-14(8-6-13)20(28)27-22(30)26-17-4-2-3-16(12-17)25-21(29)18-10-9-15(23)11-19(18)24/h2-12H,1H3,(H,25,29)(H2,26,27,28,30)