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

Systemtic Name: 5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-1-(3-piperidin-1-ylpropyl)pyrrole-3-carboxylic acid Openeye Name: 5-[2-(4-methoxyphenyl)thiazol-4-yl]-2-methyl-1-[3-(1-piperidyl)propyl]pyrrole-3-carboxylic acid CAS Name: 5-[2-(4-methoxyphenyl)-4-thiazolyl]-2-methyl-1-[3-(1-piperidinyl)propyl]-3-pyrrolecarboxylic acid IUPAC Name: 5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-1-(3-piperidin-1-ylpropyl)pyrrole-3-carboxylic acid Traditional Name: 5-[2-(4-methoxyphenyl)thiazol-4-yl]-2-methyl-1-(3-piperidinopropyl)pyrrole-3-carboxylic acid Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CCCN2CCCCC2)C3=CSC(=N3)C4=CC=C(C=C4)OC)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1CCCN2CCCCC2)C3=CSC(=N3)C4=CC=C(C=C4)OC)C(=O)O

InChI

InChI=1S/C24H29N3O3S/c1-17-20(24(28)29)15-22(27(17)14-6-13-26-11-4-3-5-12-26)21-16-31-23(25-21)18-7-9-19(30-2)10-8-18/h7-10,15-16H,3-6,11-14H2,1-2H3,(H,28,29)