3-[5-(4-methylphenyl)-1-(thiophen-2-ylcarbonylamino)pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[5-(4-methylphenyl)-1-(thiophen-2-ylcarbonylamino)pyrrol-2-yl]propanoic acid Openeye Name: 3-[5-(p-tolyl)-1-(thiophene-2-carbonylamino)pyrrol-2-yl]propanoic acid CAS Name: 3-[5-(4-methylphenyl)-1-[[oxo(thiophen-2-yl)methyl]amino]-2-pyrrolyl]propanoic acid IUPAC Name: 3-[5-(4-methylphenyl)-1-(thiophene-2-carbonylamino)pyrrol-2-yl]propanoic acid Traditional Name: 3-[5-(p-tolyl)-1-(2-thenoylamino)pyrrol-2-yl]propionic acid Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(N2NC(=O)C3=CC=CS3)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(N2NC(=O)C3=CC=CS3)CCC(=O)O

InChI

InChI=1S/C19H18N2O3S/c1-13-4-6-14(7-5-13)16-10-8-15(9-11-18(22)23)21(16)20-19(24)17-3-2-12-25-17/h2-8,10,12H,9,11H2,1H3,(H,20,24)(H,22,23)