methyl 3-[(3-bromophenyl)carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[(3-bromophenyl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[(3-bromobenzoyl)amino]benzothiophene-2-carboxylate CAS Name: 3-[[(3-bromophenyl)-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[(3-bromobenzoyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[(3-bromobenzoyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C17H12BrNO3S MolecularWeight: 390.25108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H12BrNO3S/c1-22-17(21)15-14(12-7-2-3-8-13(12)23-15)19-16(20)10-5-4-6-11(18)9-10/h2-9H,1H3,(H,19,20)