2-[2-methyl-1-(phenylmethyl)-5-[(2-phenyl-1,3-thiazol-4-yl)methoxy]indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-1-(phenylmethyl)-5-[(2-phenyl-1,3-thiazol-4-yl)methoxy]indol-3-yl]ethanoic acid Openeye Name: 2-[1-benzyl-2-methyl-5-[(2-phenylthiazol-4-yl)methoxy]indol-3-yl]acetic acid CAS Name: 2-[2-methyl-1-(phenylmethyl)-5-[(2-phenyl-4-thiazolyl)methoxy]-3-indolyl]acetic acid IUPAC Name: 2-[1-benzyl-2-methyl-5-[(2-phenyl-1,3-thiazol-4-yl)methoxy]indol-3-yl]acetic acid Traditional Name: 2-[1-benzyl-2-methyl-5-[(2-phenylthiazol-4-yl)methoxy]indol-3-yl]acetic acid Formula: C28H24N2O3S MolecularWeight: 468.56676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OCC4=CSC(=N4)C5=CC=CC=C5)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OCC4=CSC(=N4)C5=CC=CC=C5)CC(=O)O

InChI

InChI=1S/C28H24N2O3S/c1-19-24(15-27(31)32)25-14-23(12-13-26(25)30(19)16-20-8-4-2-5-9-20)33-17-22-18-34-28(29-22)21-10-6-3-7-11-21/h2-14,18H,15-17H2,1H3,(H,31,32)