methyl 3-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-(2-thienyl)propanoate CAS Name: 3-[[(4-acetyl-1H-pyrrol-2-yl)-oxomethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-(2-thienyl)propionic acid methyl ester Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)NC(CC(=O)OC)C2=CC=CS2

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)NC(CC(=O)OC)C2=CC=CS2

InChI

InChI=1S/C15H16N2O4S/c1-9(18)10-6-12(16-8-10)15(20)17-11(7-14(19)21-2)13-4-3-5-22-13/h3-6,8,11,16H,7H2,1-2H3,(H,17,20)