[5-ethanoyl-6-methyl-4-(4-nitrophenyl)-1,4-dihydropyrimidin-2-yl]cyanamide

Systemtic Name: [5-ethanoyl-6-methyl-4-(4-nitrophenyl)-1,4-dihydropyrimidin-2-yl]cyanamide Openeye Name: [5-acetyl-6-methyl-4-(4-nitrophenyl)-1,4-dihydropyrimidin-2-yl]cyanamide CAS Name: [5-acetyl-6-methyl-4-(4-nitrophenyl)-1,4-dihydropyrimidin-2-yl]cyanamide IUPAC Name: [5-acetyl-6-methyl-4-(4-nitrophenyl)-1,4-dihydropyrimidin-2-yl]cyanamide Traditional Name: [5-acetyl-6-methyl-4-(4-nitrophenyl)-1,4-dihydropyrimidin-2-yl]cyanamide Formula: C14H13N5O3 MolecularWeight: 299.28472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)NC#N)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=C(C(N=C(N1)NC#N)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C14H13N5O3/c1-8-12(9(2)20)13(18-14(17-8)16-7-15)10-3-5-11(6-4-10)19(21)22/h3-6,13H,1-2H3,(H2,16,17,18)