2-methyl-5-[2-(6-methylpyridin-3-yl)-1,3-thiazol-4-yl]-1-(oxolan-2-ylmethyl)pyrrole-3-carboxylic acid

Systemtic Name: 2-methyl-5-[2-(6-methylpyridin-3-yl)-1,3-thiazol-4-yl]-1-(oxolan-2-ylmethyl)pyrrole-3-carboxylic acid Openeye Name: 2-methyl-5-[2-(6-methyl-3-pyridyl)thiazol-4-yl]-1-(tetrahydrofuran-2-ylmethyl)pyrrole-3-carboxylic acid CAS Name: 2-methyl-5-[2-(6-methyl-3-pyridinyl)-4-thiazolyl]-1-(2-oxolanylmethyl)-3-pyrrolecarboxylic acid IUPAC Name: 2-methyl-5-[2-(6-methylpyridin-3-yl)-1,3-thiazol-4-yl]-1-(oxolan-2-ylmethyl)pyrrole-3-carboxylic acid Traditional Name: 2-methyl-5-[2-(6-methyl-3-pyridyl)thiazol-4-yl]-1-(tetrahydrofurfuryl)pyrrole-3-carboxylic acid Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C2=NC(=CS2)C3=CC(=C(N3CC4CCCO4)C)C(=O)O

Isomeric SMILES

CC1=NC=C(C=C1)C2=NC(=CS2)C3=CC(=C(N3CC4CCCO4)C)C(=O)O

InChI

InChI=1S/C20H21N3O3S/c1-12-5-6-14(9-21-12)19-22-17(11-27-19)18-8-16(20(24)25)13(2)23(18)10-15-4-3-7-26-15/h5-6,8-9,11,15H,3-4,7,10H2,1-2H3,(H,24,25)