methyl N-[[4-bromanyl-2-[(phenylmethylidene)amino]phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[4-bromanyl-2-[(phenylmethylidene)amino]phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[2-(benzylideneamino)-4-bromo-phenyl]carbamothioyl]carbamate CAS Name: N-[[4-bromo-2-[(phenylmethylene)amino]anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-(benzylideneamino)-4-bromophenyl]carbamothioyl]carbamate Traditional Name: N-[[2-(benzalamino)-4-bromo-phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C16H14BrN3O2S MolecularWeight: 392.27026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=S)NC1=C(C=C(C=C1)Br)N=CC2=CC=CC=C2

Isomeric SMILES

COC(=O)NC(=S)NC1=C(C=C(C=C1)Br)N=CC2=CC=CC=C2

InChI

InChI=1S/C16H14BrN3O2S/c1-22-16(21)20-15(23)19-13-8-7-12(17)9-14(13)18-10-11-5-3-2-4-6-11/h2-10H,1H3,(H2,19,20,21,23)