2-[(6-chloranyl-4-nitro-1H-benzimidazol-2-yl)amino]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(6-chloranyl-4-nitro-1H-benzimidazol-2-yl)amino]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(6-chloro-4-nitro-1H-benzimidazol-2-yl)amino]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(6-chloro-4-nitro-1H-benzimidazol-2-yl)amino]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(6-chloro-4-nitro-1H-benzimidazol-2-yl)amino]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(6-chloro-4-nitro-1H-benzimidazol-2-yl)amino]-6-methyl-1H-pyrimidin-4-one Formula: C12H9ClN6O3 MolecularWeight: 320.69126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)NC2=NC3=C(C=C(C=C3N2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)N=C(N1)NC2=NC3=C(C=C(C=C3N2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H9ClN6O3/c1-5-2-9(20)16-11(14-5)18-12-15-7-3-6(13)4-8(19(21)22)10(7)17-12/h2-4H,1H3,(H3,14,15,16,17,18,20)