[2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxidanylidene-ethyl] 3-azanylpyrazine-2-carboxylate

Systemtic Name: [2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxidanylidene-ethyl] 3-azanylpyrazine-2-carboxylate Openeye Name: [2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxo-ethyl] 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid [2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxoethyl] 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid [2-[2-(2,4-dichlorophenyl)pentylamino]-2-keto-ethyl] ester Formula: C18H20Cl2N4O3 MolecularWeight: 411.2824

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CNC(=O)COC(=O)C1=NC=CN=C1N)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCC(CNC(=O)COC(=O)C1=NC=CN=C1N)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H20Cl2N4O3/c1-2-3-11(13-5-4-12(19)8-14(13)20)9-24-15(25)10-27-18(26)16-17(21)23-7-6-22-16/h4-8,11H,2-3,9-10H2,1H3,(H2,21,23)(H,24,25)