ethyl 2-[2-(5-pyridin-3-yl-2-thiophen-2-ylcarbonyl-3,4-dihydropyrazol-3-yl)phenoxy]ethanoate

Systemtic Name: ethyl 2-[2-(5-pyridin-3-yl-2-thiophen-2-ylcarbonyl-3,4-dihydropyrazol-3-yl)phenoxy]ethanoate Openeye Name: ethyl 2-[2-[5-(3-pyridyl)-2-(thiophene-2-carbonyl)-3,4-dihydropyrazol-3-yl]phenoxy]acetate CAS Name: 2-[2-[2-[oxo(thiophen-2-yl)methyl]-5-(3-pyridinyl)-3,4-dihydropyrazol-3-yl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[5-pyridin-3-yl-2-(thiophene-2-carbonyl)-3,4-dihydropyrazol-3-yl]phenoxy]acetate Traditional Name: 2-[2-[5-(3-pyridyl)-2-(2-thenoyl)-2-pyrazolin-3-yl]phenoxy]acetic acid ethyl ester Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=CC=C1C2CC(=NN2C(=O)C3=CC=CS3)C4=CN=CC=C4

Isomeric SMILES

CCOC(=O)COC1=CC=CC=C1C2CC(=NN2C(=O)C3=CC=CS3)C4=CN=CC=C4

InChI

InChI=1S/C23H21N3O4S/c1-2-29-22(27)15-30-20-9-4-3-8-17(20)19-13-18(16-7-5-11-24-14-16)25-26(19)23(28)21-10-6-12-31-21/h3-12,14,19H,2,13,15H2,1H3