ethyl 3-[6-methyl-2-oxidanylidene-3-[2-(phenylmethyl)sulfonylhydrazinyl]pyrazin-1-yl]propanoate

Systemtic Name: ethyl 3-[6-methyl-2-oxidanylidene-3-[2-(phenylmethyl)sulfonylhydrazinyl]pyrazin-1-yl]propanoate Openeye Name: ethyl 3-[3-(2-benzylsulfonylhydrazino)-6-methyl-2-oxo-pyrazin-1-yl]propanoate CAS Name: 3-[6-methyl-2-oxo-3-[(phenylmethyl)sulfonylhydrazo]-1-pyrazinyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-(2-benzylsulfonylhydrazinyl)-6-methyl-2-oxopyrazin-1-yl]propanoate Traditional Name: 3-[3-(N'-benzylsulfonylhydrazino)-2-keto-6-methyl-pyrazin-1-yl]propionic acid ethyl ester Formula: C17H22N4O5S MolecularWeight: 394.44538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C(=CN=C(C1=O)NNS(=O)(=O)CC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)CCN1C(=CN=C(C1=O)NNS(=O)(=O)CC2=CC=CC=C2)C

InChI

InChI=1S/C17H22N4O5S/c1-3-26-15(22)9-10-21-13(2)11-18-16(17(21)23)19-20-27(24,25)12-14-7-5-4-6-8-14/h4-8,11,20H,3,9-10,12H2,1-2H3,(H,18,19)