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

Systemtic Name: 3-chloranyl-N-[4-[[4-(phenoxymethyl)phenyl]carbonylcarbamothioylamino]phenyl]benzamide Openeye Name: 3-chloro-N-[4-[[4-(phenoxymethyl)benzoyl]carbamothioylamino]phenyl]benzamide CAS Name: 3-chloro-N-[4-[[[[oxo-[4-(phenoxymethyl)phenyl]methyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 3-chloro-N-[4-[[4-(phenoxymethyl)benzoyl]carbamothioylamino]phenyl]benzamide Traditional Name: 3-chloro-N-[4-[[4-(phenoxymethyl)benzoyl]thiocarbamoylamino]phenyl]benzamide Formula: C28H22ClN3O3S MolecularWeight: 516.01058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C28H22ClN3O3S/c29-22-6-4-5-21(17-22)27(34)30-23-13-15-24(16-14-23)31-28(36)32-26(33)20-11-9-19(10-12-20)18-35-25-7-2-1-3-8-25/h1-17H,18H2,(H,30,34)(H2,31,32,33,36)