ethyl 2,2-dimethyl-5-[4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenoxy]pentanoate

Systemtic Name: ethyl 2,2-dimethyl-5-[4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenoxy]pentanoate Openeye Name: ethyl 2,2-dimethyl-5-[4-[2-(3-pyridyl)thiazol-4-yl]phenoxy]pentanoate CAS Name: 2,2-dimethyl-5-[4-[2-(3-pyridinyl)-4-thiazolyl]phenoxy]pentanoic acid ethyl ester IUPAC Name: ethyl 2,2-dimethyl-5-[4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenoxy]pentanoate Traditional Name: 2,2-dimethyl-5-[4-[2-(3-pyridyl)thiazol-4-yl]phenoxy]valeric acid ethyl ester Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CCCOC1=CC=C(C=C1)C2=CSC(=N2)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C(C)(C)CCCOC1=CC=C(C=C1)C2=CSC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C23H26N2O3S/c1-4-27-22(26)23(2,3)12-6-14-28-19-10-8-17(9-11-19)20-16-29-21(25-20)18-7-5-13-24-15-18/h5,7-11,13,15-16H,4,6,12,14H2,1-3H3