(phenylmethyl) N-[[5-chloranyl-2-[(phenylmethyl)amino]phenyl]carbamothioyl]carbamate

Systemtic Name: (phenylmethyl) N-[[5-chloranyl-2-[(phenylmethyl)amino]phenyl]carbamothioyl]carbamate Openeye Name: benzyl N-[[2-(benzylamino)-5-chloro-phenyl]carbamothioyl]carbamate CAS Name: N-[[5-chloro-2-[(phenylmethyl)amino]anilino]-sulfanylidenemethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[[2-(benzylamino)-5-chlorophenyl]carbamothioyl]carbamate Traditional Name: N-[[2-(benzylamino)-5-chloro-phenyl]thiocarbamoyl]carbamic acid benzyl ester Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)Cl)NC(=S)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)Cl)NC(=S)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H20ClN3O2S/c23-18-11-12-19(24-14-16-7-3-1-4-8-16)20(13-18)25-21(29)26-22(27)28-15-17-9-5-2-6-10-17/h1-13,24H,14-15H2,(H2,25,26,27,29)