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

Systemtic Name: 1-(diphenylmethyl)-5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid Openeye Name: 1-benzhydryl-5-[2-(4-methoxyphenyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid CAS Name: 1-(diphenylmethyl)-5-[2-(4-methoxyphenyl)-4-thiazolyl]-2-methyl-3-pyrrolecarboxylic acid IUPAC Name: 1-benzhydryl-5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methylpyrrole-3-carboxylic acid Traditional Name: 1-benzhydryl-5-[2-(4-methoxyphenyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid Formula: C29H24N2O3S MolecularWeight: 480.57746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CSC(=N4)C5=CC=C(C=C5)OC)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CSC(=N4)C5=CC=C(C=C5)OC)C(=O)O

InChI

InChI=1S/C29H24N2O3S/c1-19-24(29(32)33)17-26(25-18-35-28(30-25)22-13-15-23(34-2)16-14-22)31(19)27(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-18,27H,1-2H3,(H,32,33)