[2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate Openeye Name: [2-(1-adamantylcarbamoylamino)-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-[[(1-adamantylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylcarbamoylamino)-2-oxoethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-(1-adamantylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)COC(=O)C4=NC=CN=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)COC(=O)C4=NC=CN=C4

InChI

InChI=1S/C18H22N4O4/c23-15(10-26-16(24)14-9-19-1-2-20-14)21-17(25)22-18-6-11-3-12(7-18)5-13(4-11)8-18/h1-2,9,11-13H,3-8,10H2,(H2,21,22,23,25)