N-[4-[[3,5-bis(chloranyl)-4-phenylmethoxy-phenyl]carbamothioylamino]phenyl]ethanamide

Systemtic Name: N-[4-[[3,5-bis(chloranyl)-4-phenylmethoxy-phenyl]carbamothioylamino]phenyl]ethanamide Openeye Name: N-[4-[(4-benzyloxy-3,5-dichloro-phenyl)carbamothioylamino]phenyl]acetamide CAS Name: N-[4-[[(3,5-dichloro-4-phenylmethoxyanilino)-sulfanylidenemethyl]amino]phenyl]acetamide IUPAC Name: N-[4-[(3,5-dichloro-4-phenylmethoxyphenyl)carbamothioylamino]phenyl]acetamide Traditional Name: N-[4-[(4-benzoxy-3,5-dichloro-phenyl)thiocarbamoylamino]phenyl]acetamide Formula: C22H19Cl2N3O2S MolecularWeight: 460.37616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C(=C2)Cl)OCC3=CC=CC=C3)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C(=C2)Cl)OCC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H19Cl2N3O2S/c1-14(28)25-16-7-9-17(10-8-16)26-22(30)27-18-11-19(23)21(20(24)12-18)29-13-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,25,28)(H2,26,27,30)