2-[5-[3-[4-(4-ethyl-1,3-thiazol-2-yl)-2-propyl-phenoxy]propoxy]indol-1-yl]ethanoic acid

Systemtic Name: 2-[5-[3-[4-(4-ethyl-1,3-thiazol-2-yl)-2-propyl-phenoxy]propoxy]indol-1-yl]ethanoic acid Openeye Name: 2-[5-[3-[4-(4-ethylthiazol-2-yl)-2-propyl-phenoxy]propoxy]indol-1-yl]acetic acid CAS Name: 2-[5-[3-[4-(4-ethyl-2-thiazolyl)-2-propylphenoxy]propoxy]-1-indolyl]acetic acid IUPAC Name: 2-[5-[3-[4-(4-ethyl-1,3-thiazol-2-yl)-2-propylphenoxy]propoxy]indol-1-yl]acetic acid Traditional Name: 2-[5-[3-[4-(4-ethylthiazol-2-yl)-2-propyl-phenoxy]propoxy]indol-1-yl]acetic acid Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C2=NC(=CS2)CC)OCCCOC3=CC4=C(C=C3)N(C=C4)CC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)C2=NC(=CS2)CC)OCCCOC3=CC4=C(C=C3)N(C=C4)CC(=O)O

InChI

InChI=1S/C27H30N2O4S/c1-3-6-20-15-21(27-28-22(4-2)18-34-27)7-10-25(20)33-14-5-13-32-23-8-9-24-19(16-23)11-12-29(24)17-26(30)31/h7-12,15-16,18H,3-6,13-14,17H2,1-2H3,(H,30,31)