ethyl 2-(hexylamino)-6-oxidanylidene-1H-pyrimidine-5-carboxylate; pyrimidine

Systemtic Name: ethyl 2-(hexylamino)-6-oxidanylidene-1H-pyrimidine-5-carboxylate; pyrimidine Openeye Name: ethyl 2-(hexylamino)-6-oxo-1H-pyrimidine-5-carboxylate; pyrimidine CAS Name: 2-(hexylamino)-6-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester; pyrimidine IUPAC Name: ethyl 2-(hexylamino)-6-oxo-1H-pyrimidine-5-carboxylate; pyrimidine Traditional Name: 2-(hexylamino)-6-keto-1H-pyrimidine-5-carboxylic acid ethyl ester; pyrimidine Formula: C17H25N5O3 MolecularWeight: 347.4121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=NC=C(C(=O)N1)C(=O)OCC.C1=CN=CN=C1

Isomeric SMILES

CCCCCCNC1=NC=C(C(=O)N1)C(=O)OCC.C1=CN=CN=C1

InChI

InChI=1S/C13H21N3O3.C4H4N2/c1-3-5-6-7-8-14-13-15-9-10(11(17)16-13)12(18)19-4-2;1-2-5-4-6-3-1/h9H,3-8H2,1-2H3,(H2,14,15,16,17);1-4H