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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=CC(=C3)NC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=CC(=C3)NC(=O)C4=CC(=CC=C4)Cl

InChI

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