3-chloranyl-N-[3-[(4-methoxyphenyl)carbonylcarbamothioylamino]phenyl]benzamide

Systemtic Name: 3-chloranyl-N-[3-[(4-methoxyphenyl)carbonylcarbamothioylamino]phenyl]benzamide Openeye Name: 3-chloro-N-[3-[(4-methoxybenzoyl)carbamothioylamino]phenyl]benzamide CAS Name: 3-chloro-N-[3-[[[[(4-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 3-chloro-N-[3-[(4-methoxybenzoyl)carbamothioylamino]phenyl]benzamide Traditional Name: 3-chloro-N-[3-(p-anisoylthiocarbamoylamino)phenyl]benzamide Formula: C22H18ClN3O3S MolecularWeight: 439.91462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H18ClN3O3S/c1-29-19-10-8-14(9-11-19)20(27)26-22(30)25-18-7-3-6-17(13-18)24-21(28)15-4-2-5-16(23)12-15/h2-13H,1H3,(H,24,28)(H2,25,26,27,30)