1-butyl-5-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-butyl-5-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid Openeye Name: 1-butyl-5-[2-(2-chlorophenyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid CAS Name: 1-butyl-5-[2-(2-chlorophenyl)-4-thiazolyl]-2-methyl-3-pyrrolecarboxylic acid IUPAC Name: 1-butyl-5-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-2-methylpyrrole-3-carboxylic acid Traditional Name: 1-butyl-5-[2-(2-chlorophenyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid Formula: C19H19ClN2O2S MolecularWeight: 374.88436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C=C1C2=CSC(=N2)C3=CC=CC=C3Cl)C(=O)O)C

Isomeric SMILES

CCCCN1C(=C(C=C1C2=CSC(=N2)C3=CC=CC=C3Cl)C(=O)O)C

InChI

InChI=1S/C19H19ClN2O2S/c1-3-4-9-22-12(2)14(19(23)24)10-17(22)16-11-25-18(21-16)13-7-5-6-8-15(13)20/h5-8,10-11H,3-4,9H2,1-2H3,(H,23,24)