methyl 4-[(2-bromophenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: methyl 4-[(2-bromophenyl)carbonylcarbamothioylamino]benzoate Openeye Name: methyl 4-[(2-bromobenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[(2-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-bromobenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(2-bromobenzoyl)thiocarbamoylamino]benzoic acid methyl ester Formula: C16H13BrN2O3S MolecularWeight: 393.25502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C16H13BrN2O3S/c1-22-15(21)10-6-8-11(9-7-10)18-16(23)19-14(20)12-4-2-3-5-13(12)17/h2-9H,1H3,(H2,18,19,20,23)