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

Systemtic Name: 1-(3-methoxypropyl)-2-methyl-5-[2-(phenoxymethyl)-1,3-thiazol-4-yl]pyrrole-3-carboxylic acid Openeye Name: 1-(3-methoxypropyl)-2-methyl-5-[2-(phenoxymethyl)thiazol-4-yl]pyrrole-3-carboxylic acid CAS Name: 1-(3-methoxypropyl)-2-methyl-5-[2-(phenoxymethyl)-4-thiazolyl]-3-pyrrolecarboxylic acid IUPAC Name: 1-(3-methoxypropyl)-2-methyl-5-[2-(phenoxymethyl)-1,3-thiazol-4-yl]pyrrole-3-carboxylic acid Traditional Name: 1-(3-methoxypropyl)-2-methyl-5-[2-(phenoxymethyl)thiazol-4-yl]pyrrole-3-carboxylic acid Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CCCOC)C2=CSC(=N2)COC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1CCCOC)C2=CSC(=N2)COC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H22N2O4S/c1-14-16(20(23)24)11-18(22(14)9-6-10-25-2)17-13-27-19(21-17)12-26-15-7-4-3-5-8-15/h3-5,7-8,11,13H,6,9-10,12H2,1-2H3,(H,23,24)