ethyl 2-[2-oxidanylidene-6-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-1,3-benzoxazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-oxidanylidene-6-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-1,3-benzoxazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-oxo-6-[4-(2-pyridyl)piperazin-1-yl]sulfonyl-1,3-benzoxazol-3-yl]acetate CAS Name: 2-[2-oxo-6-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]-1,3-benzoxazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-oxo-6-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-1,3-benzoxazol-3-yl]acetate Traditional Name: 2-[2-keto-6-[4-(2-pyridyl)piperazino]sulfonyl-1,3-benzoxazol-3-yl]acetic acid ethyl ester Formula: C20H22N4O6S MolecularWeight: 446.47688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4)OC1=O

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4)OC1=O

InChI

InChI=1S/C20H22N4O6S/c1-2-29-19(25)14-24-16-7-6-15(13-17(16)30-20(24)26)31(27,28)23-11-9-22(10-12-23)18-5-3-4-8-21-18/h3-8,13H,2,9-12,14H2,1H3