N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]phenyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]phenyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[4-[(5-chloro-2,4-dimethoxy-phenyl)carbamothioylamino]phenyl]benzamide CAS Name: N-[4-[[(5-chloro-2,4-dimethoxyanilino)-sulfanylidenemethyl]amino]phenyl]-3-phenylmethoxybenzamide IUPAC Name: N-[4-[(5-chloro-2,4-dimethoxyphenyl)carbamothioylamino]phenyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[4-[(5-chloro-2,4-dimethoxy-phenyl)thiocarbamoylamino]phenyl]benzamide Formula: C29H26ClN3O4S MolecularWeight: 548.05244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4)Cl)OC

InChI

InChI=1S/C29H26ClN3O4S/c1-35-26-17-27(36-2)25(16-24(26)30)33-29(38)32-22-13-11-21(12-14-22)31-28(34)20-9-6-10-23(15-20)37-18-19-7-4-3-5-8-19/h3-17H,18H2,1-2H3,(H,31,34)(H2,32,33,38)