methyl 4-[[(5-bromanylthiophen-2-yl)carbonylamino]carbamoyl]benzoate

Systemtic Name: methyl 4-[[(5-bromanylthiophen-2-yl)carbonylamino]carbamoyl]benzoate Openeye Name: methyl 4-[[(5-bromothiophene-2-carbonyl)amino]carbamoyl]benzoate CAS Name: 4-[[[(5-bromo-2-thiophenyl)-oxomethyl]hydrazo]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(5-bromothiophene-2-carbonyl)amino]carbamoyl]benzoate Traditional Name: 4-[[(5-bromothiophene-2-carbonyl)amino]carbamoyl]benzoic acid methyl ester Formula: C14H11BrN2O4S MolecularWeight: 383.21714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=C(S2)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C14H11BrN2O4S/c1-21-14(20)9-4-2-8(3-5-9)12(18)16-17-13(19)10-6-7-11(15)22-10/h2-7H,1H3,(H,16,18)(H,17,19)