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

Systemtic Name: 5-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-2-methyl-1-(oxolan-2-ylmethyl)pyrrole-3-carboxylic acid Openeye Name: 5-[2-(2-chlorophenyl)thiazol-4-yl]-2-methyl-1-(tetrahydrofuran-2-ylmethyl)pyrrole-3-carboxylic acid CAS Name: 5-[2-(2-chlorophenyl)-4-thiazolyl]-2-methyl-1-(2-oxolanylmethyl)-3-pyrrolecarboxylic acid IUPAC Name: 5-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-2-methyl-1-(oxolan-2-ylmethyl)pyrrole-3-carboxylic acid Traditional Name: 5-[2-(2-chlorophenyl)thiazol-4-yl]-2-methyl-1-(tetrahydrofurfuryl)pyrrole-3-carboxylic acid Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC2CCCO2)C3=CSC(=N3)C4=CC=CC=C4Cl)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1CC2CCCO2)C3=CSC(=N3)C4=CC=CC=C4Cl)C(=O)O

InChI

InChI=1S/C20H19ClN2O3S/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/h2-3,6-7,9,11,13H,4-5,8,10H2,1H3,(H,24,25)