5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-1-(2-morpholin-4-ylethyl)pyrrole-3-carboxylic acid

Systemtic Name: 5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-1-(2-morpholin-4-ylethyl)pyrrole-3-carboxylic acid Openeye Name: 5-[2-(4-methoxyphenyl)thiazol-4-yl]-2-methyl-1-(2-morpholinoethyl)pyrrole-3-carboxylic acid CAS Name: 5-[2-(4-methoxyphenyl)-4-thiazolyl]-2-methyl-1-[2-(4-morpholinyl)ethyl]-3-pyrrolecarboxylic acid IUPAC Name: 5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-1-(2-morpholin-4-ylethyl)pyrrole-3-carboxylic acid Traditional Name: 5-[2-(4-methoxyphenyl)thiazol-4-yl]-2-methyl-1-(2-morpholinoethyl)pyrrole-3-carboxylic acid Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CCN2CCOCC2)C3=CSC(=N3)C4=CC=C(C=C4)OC)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1CCN2CCOCC2)C3=CSC(=N3)C4=CC=C(C=C4)OC)C(=O)O

InChI

InChI=1S/C22H25N3O4S/c1-15-18(22(26)27)13-20(25(15)8-7-24-9-11-29-12-10-24)19-14-30-21(23-19)16-3-5-17(28-2)6-4-16/h3-6,13-14H,7-12H2,1-2H3,(H,26,27)