3-[(4R)-2-[7-(cyclopentylamino)-5-phenoxy-1H-indol-2-yl]-4,5-dihydro-1,3-thiazol-4-yl]propanoic acid

Systemtic Name: 3-[(4R)-2-[7-(cyclopentylamino)-5-phenoxy-1H-indol-2-yl]-4,5-dihydro-1,3-thiazol-4-yl]propanoic acid Openeye Name: 3-[(4R)-2-[7-(cyclopentylamino)-5-phenoxy-1H-indol-2-yl]-4,5-dihydrothiazol-4-yl]propanoic acid CAS Name: 3-[(4R)-2-[7-(cyclopentylamino)-5-phenoxy-1H-indol-2-yl]-4,5-dihydrothiazol-4-yl]propanoic acid IUPAC Name: 3-[(4R)-2-[7-(cyclopentylamino)-5-phenoxy-1H-indol-2-yl]-4,5-dihydro-1,3-thiazol-4-yl]propanoic acid Traditional Name: 3-[(4R)-2-[7-(cyclopentylamino)-5-phenoxy-1H-indol-2-yl]-2-thiazolin-4-yl]propionic acid Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=C3C(=CC(=C2)OC4=CC=CC=C4)C=C(N3)C5=NC(CS5)CCC(=O)O

Isomeric SMILES

C1CCC(C1)NC2=C3C(=CC(=C2)OC4=CC=CC=C4)C=C(N3)C5=N[C@@H](CS5)CCC(=O)O

InChI

InChI=1S/C25H27N3O3S/c29-23(30)11-10-18-15-32-25(27-18)22-13-16-12-20(31-19-8-2-1-3-9-19)14-21(24(16)28-22)26-17-6-4-5-7-17/h1-3,8-9,12-14,17-18,26,28H,4-7,10-11,15H2,(H,29,30)/t18-/m1/s1