3-[(3-pyrrol-1-ylthiophen-2-yl)carbonylamino]butanoic acid

Systemtic Name: 3-[(3-pyrrol-1-ylthiophen-2-yl)carbonylamino]butanoic acid Openeye Name: 3-[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]butanoic acid CAS Name: 3-[[oxo-[3-(1-pyrrolyl)-2-thiophenyl]methyl]amino]butanoic acid IUPAC Name: 3-[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]butanoic acid Traditional Name: 3-[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]butyric acid Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)C1=C(C=CS1)N2C=CC=C2

Isomeric SMILES

CC(CC(=O)O)NC(=O)C1=C(C=CS1)N2C=CC=C2

InChI

InChI=1S/C13H14N2O3S/c1-9(8-11(16)17)14-13(18)12-10(4-7-19-12)15-5-2-3-6-15/h2-7,9H,8H2,1H3,(H,14,18)(H,16,17)