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

Systemtic Name: 5-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-1-(furan-2-ylmethyl)-2-methyl-pyrrole-3-carboxylic acid Openeye Name: 5-[2-(2-chlorophenyl)thiazol-4-yl]-1-(2-furylmethyl)-2-methyl-pyrrole-3-carboxylic acid CAS Name: 5-[2-(2-chlorophenyl)-4-thiazolyl]-1-(2-furanylmethyl)-2-methyl-3-pyrrolecarboxylic acid IUPAC Name: 5-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-1-(furan-2-ylmethyl)-2-methylpyrrole-3-carboxylic acid Traditional Name: 5-[2-(2-chlorophenyl)thiazol-4-yl]-1-(2-furfuryl)-2-methyl-pyrrole-3-carboxylic acid Formula: C20H15ClN2O3S MolecularWeight: 398.8627

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC2=CC=CO2)C3=CSC(=N3)C4=CC=CC=C4Cl)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1CC2=CC=CO2)C3=CSC(=N3)C4=CC=CC=C4Cl)C(=O)O

InChI

InChI=1S/C20H15ClN2O3S/c1-12-15(20(24)25)9-18(23(12)10-13-5-4-8-26-13)17-11-27-19(22-17)14-6-2-3-7-16(14)21/h2-9,11H,10H2,1H3,(H,24,25)