(6E)-2-(2-azanylethylamino)-6-[(3-methylphenyl)-nitroso-methylidene]-1H-pyrimidine-5-carboxamide

Systemtic Name: (6E)-2-(2-azanylethylamino)-6-[(3-methylphenyl)-nitroso-methylidene]-1H-pyrimidine-5-carboxamide Openeye Name: (6E)-2-(2-aminoethylamino)-6-[m-tolyl(nitroso)methylene]-1H-pyrimidine-5-carboxamide CAS Name: (6E)-2-(2-aminoethylamino)-6-[(3-methylphenyl)-nitrosomethylidene]-1H-pyrimidine-5-carboxamide IUPAC Name: (6E)-2-(2-aminoethylamino)-6-[(3-methylphenyl)-nitrosomethylidene]-1H-pyrimidine-5-carboxamide Traditional Name: (6E)-2-(2-aminoethylamino)-6-[m-tolyl(nitroso)methylene]-1H-pyrimidine-5-carboxamide Formula: C15H18N6O2 MolecularWeight: 314.34242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=C2C(=CN=C(N2)NCCN)C(=O)N)N=O

Isomeric SMILES

CC1=CC=CC(=C1)/C(=C\2/C(=CN=C(N2)NCCN)C(=O)N)/N=O

InChI

InChI=1S/C15H18N6O2/c1-9-3-2-4-10(7-9)12(21-23)13-11(14(17)22)8-19-15(20-13)18-6-5-16/h2-4,7-8H,5-6,16H2,1H3,(H2,17,22)(H2,18,19,20)/b13-12+