(phenylmethyl) 3-azanyl-6-chloranyl-5-(prop-2-enylamino)pyrazine-2-carboxylate

Systemtic Name: (phenylmethyl) 3-azanyl-6-chloranyl-5-(prop-2-enylamino)pyrazine-2-carboxylate Openeye Name: benzyl 5-(allylamino)-3-amino-6-chloro-pyrazine-2-carboxylate CAS Name: 3-amino-6-chloro-5-(prop-2-enylamino)-2-pyrazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-amino-6-chloro-5-(prop-2-enylamino)pyrazine-2-carboxylate Traditional Name: 5-(allylamino)-3-amino-6-chloro-pyrazinic acid benzyl ester Formula: C15H15ClN4O2 MolecularWeight: 318.7582

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=C(N=C1Cl)C(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

C=CCNC1=NC(=C(N=C1Cl)C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C15H15ClN4O2/c1-2-8-18-14-12(16)19-11(13(17)20-14)15(21)22-9-10-6-4-3-5-7-10/h2-7H,1,8-9H2,(H3,17,18,20)