3-[6-[(4-methyl-1,3-thiazol-2-yl)amino]-5-phenoxy-pyridin-3-yl]propanoic acid hydrochloride

Systemtic Name: 3-[6-[(4-methyl-1,3-thiazol-2-yl)amino]-5-phenoxy-pyridin-3-yl]propanoic acid hydrochloride Openeye Name: 3-[6-[(4-methylthiazol-2-yl)amino]-5-phenoxy-3-pyridyl]propanoic acid hydrochloride CAS Name: 3-[6-[(4-methyl-2-thiazolyl)amino]-5-phenoxy-3-pyridinyl]propanoic acid hydrochloride IUPAC Name: 3-[6-[(4-methyl-1,3-thiazol-2-yl)amino]-5-phenoxypyridin-3-yl]propanoic acid hydrochloride Traditional Name: 3-[6-[(4-methylthiazol-2-yl)amino]-5-phenoxy-3-pyridyl]propionic acid hydrochloride Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC2=C(C=C(C=N2)CCC(=O)O)OC3=CC=CC=C3.Cl

Isomeric SMILES

CC1=CSC(=N1)NC2=C(C=C(C=N2)CCC(=O)O)OC3=CC=CC=C3.Cl

InChI

InChI=1S/C18H17N3O3S.ClH/c1-12-11-25-18(20-12)21-17-15(24-14-5-3-2-4-6-14)9-13(10-19-17)7-8-16(22)23;/h2-6,9-11H,7-8H2,1H3,(H,22,23)(H,19,20,21);1H