2-[2-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-butan-2-yl-pyrrol-1-yl]ethanoic acid

Systemtic Name: 2-[2-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-butan-2-yl-pyrrol-1-yl]ethanoic acid Openeye Name: 2-[2-[4,5-bis(4-methoxyphenyl)thiazol-2-yl]-3-sec-butyl-pyrrol-1-yl]acetic acid CAS Name: 2-[2-[4,5-bis(4-methoxyphenyl)-2-thiazolyl]-3-butan-2-yl-1-pyrrolyl]acetic acid IUPAC Name: 2-[2-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-butan-2-ylpyrrol-1-yl]acetic acid Traditional Name: 2-[2-[4,5-bis(4-methoxyphenyl)thiazol-2-yl]-3-sec-butyl-pyrrol-1-yl]acetic acid Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(N(C=C1)CC(=O)O)C2=NC(=C(S2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

Isomeric SMILES

CCC(C)C1=C(N(C=C1)CC(=O)O)C2=NC(=C(S2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H28N2O4S/c1-5-17(2)22-14-15-29(16-23(30)31)25(22)27-28-24(18-6-10-20(32-3)11-7-18)26(34-27)19-8-12-21(33-4)13-9-19/h6-15,17H,5,16H2,1-4H3,(H,30,31)