[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-oxidanylidene-ethyl] 2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanoate

Systemtic Name: [2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-oxidanylidene-ethyl] 2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanoate Openeye Name: [2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-oxo-ethyl] 2-[2-(2-pyridyl)thiazol-4-yl]acetate CAS Name: 2-[2-(2-pyridinyl)-4-thiazolyl]acetic acid [2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-oxoethyl] 2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetate Traditional Name: 2-[2-(2-pyridyl)thiazol-4-yl]acetic acid [2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-keto-ethyl] ester Formula: C21H19N3O5S MolecularWeight: 425.45766

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC(=O)COC(=O)CC3=CSC(=N3)C4=CC=CC=N4

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CNC(=O)COC(=O)CC3=CSC(=N3)C4=CC=CC=N4

InChI

InChI=1S/C21H19N3O5S/c25-19(23-10-15-11-27-17-6-1-2-7-18(17)29-15)12-28-20(26)9-14-13-30-21(24-14)16-5-3-4-8-22-16/h1-8,13,15H,9-12H2,(H,23,25)