6-(benzimidazol-1-yl)-5-nitro-N-(pyridin-3-ylmethyl)pyrimidin-4-amine

Systemtic Name: 6-(benzimidazol-1-yl)-5-nitro-N-(pyridin-3-ylmethyl)pyrimidin-4-amine Openeye Name: 6-(benzimidazol-1-yl)-5-nitro-N-(3-pyridylmethyl)pyrimidin-4-amine CAS Name: 6-(1-benzimidazolyl)-5-nitro-N-(3-pyridinylmethyl)-4-pyrimidinamine IUPAC Name: 6-(benzimidazol-1-yl)-5-nitro-N-(pyridin-3-ylmethyl)pyrimidin-4-amine Traditional Name: [6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C17H13N7O2 MolecularWeight: 347.33082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2C3=C(C(=NC=N3)NCC4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2C3=C(C(=NC=N3)NCC4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H13N7O2/c25-24(26)15-16(19-9-12-4-3-7-18-8-12)20-10-21-17(15)23-11-22-13-5-1-2-6-14(13)23/h1-8,10-11H,9H2,(H,19,20,21)