methyl 6-chloranyl-5-(dimethylamino)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pyrazine-2-carboxylate

Systemtic Name: methyl 6-chloranyl-5-(dimethylamino)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pyrazine-2-carboxylate Openeye Name: methyl 3-(tert-butoxycarbonylamino)-6-chloro-5-(dimethylamino)pyrazine-2-carboxylate CAS Name: 6-chloro-5-(dimethylamino)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 6-chloro-5-(dimethylamino)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pyrazine-2-carboxylate Traditional Name: 3-(tert-butoxycarbonylamino)-6-chloro-5-(dimethylamino)pyrazinic acid methyl ester Formula: C13H19ClN4O4 MolecularWeight: 330.76736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(N=C(C(=N1)N(C)C)Cl)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(N=C(C(=N1)N(C)C)Cl)C(=O)OC

InChI

InChI=1S/C13H19ClN4O4/c1-13(2,3)22-12(20)17-9-7(11(19)21-6)15-8(14)10(16-9)18(4)5/h1-6H3,(H,16,17,20)