methyl 2-methoxy-5-[[(3-pyrrol-1-ylthiophen-2-yl)carbonylamino]methyl]benzoate

Systemtic Name: methyl 2-methoxy-5-[[(3-pyrrol-1-ylthiophen-2-yl)carbonylamino]methyl]benzoate Openeye Name: methyl 2-methoxy-5-[[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]methyl]benzoate CAS Name: 2-methoxy-5-[[[oxo-[3-(1-pyrrolyl)-2-thiophenyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-5-[[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]methyl]benzoate Traditional Name: 2-methoxy-5-[[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CS2)N3C=CC=C3)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CS2)N3C=CC=C3)C(=O)OC

InChI

InChI=1S/C19H18N2O4S/c1-24-16-6-5-13(11-14(16)19(23)25-2)12-20-18(22)17-15(7-10-26-17)21-8-3-4-9-21/h3-11H,12H2,1-2H3,(H,20,22)