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

Systemtic Name: 5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-1-[(4-propan-2-ylphenyl)methyl]pyrrole-3-carboxylic acid Openeye Name: 1-[(4-isopropylphenyl)methyl]-5-[2-(4-methoxyphenyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid CAS Name: 5-[2-(4-methoxyphenyl)-4-thiazolyl]-2-methyl-1-[(4-propan-2-ylphenyl)methyl]-3-pyrrolecarboxylic acid IUPAC Name: 5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-1-[(4-propan-2-ylphenyl)methyl]pyrrole-3-carboxylic acid Traditional Name: 1-(4-isopropylbenzyl)-5-[2-(4-methoxyphenyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid Formula: C26H26N2O3S MolecularWeight: 446.56124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC2=CC=C(C=C2)C(C)C)C3=CSC(=N3)C4=CC=C(C=C4)OC)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1CC2=CC=C(C=C2)C(C)C)C3=CSC(=N3)C4=CC=C(C=C4)OC)C(=O)O

InChI

InChI=1S/C26H26N2O3S/c1-16(2)19-7-5-18(6-8-19)14-28-17(3)22(26(29)30)13-24(28)23-15-32-25(27-23)20-9-11-21(31-4)12-10-20/h5-13,15-16H,14H2,1-4H3,(H,29,30)