methyl 3-[(3-pyrrol-1-ylthiophen-2-yl)carbonylamino]benzoate

Systemtic Name: methyl 3-[(3-pyrrol-1-ylthiophen-2-yl)carbonylamino]benzoate Openeye Name: methyl 3-[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]benzoate CAS Name: 3-[[oxo-[3-(1-pyrrolyl)-2-thiophenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]benzoate Traditional Name: 3-[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]benzoic acid methyl ester Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)C2=C(C=CS2)N3C=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)C2=C(C=CS2)N3C=CC=C3

InChI

InChI=1S/C17H14N2O3S/c1-22-17(21)12-5-4-6-13(11-12)18-16(20)15-14(7-10-23-15)19-8-2-3-9-19/h2-11H,1H3,(H,18,20)