[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C13H18N4O4 MolecularWeight: 294.30642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)C1=NC=CN=C1

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)C1=NC=CN=C1

InChI

InChI=1S/C13H18N4O4/c1-9(2)3-4-16-13(20)17-11(18)8-21-12(19)10-7-14-5-6-15-10/h5-7,9H,3-4,8H2,1-2H3,(H2,16,17,18,20)