4-(1-methylimidazol-2-yl)-8-nitro-2-piperazin-1-yl-[1]benzofuro[3,2-d]pyrimidine

Systemtic Name: 4-(1-methylimidazol-2-yl)-8-nitro-2-piperazin-1-yl-[1]benzofuro[3,2-d]pyrimidine Openeye Name: 4-(1-methylimidazol-2-yl)-8-nitro-2-piperazin-1-yl-benzofuro[3,2-d]pyrimidine CAS Name: 4-(1-methyl-2-imidazolyl)-8-nitro-2-(1-piperazinyl)benzofuro[3,2-d]pyrimidine IUPAC Name: 4-(1-methylimidazol-2-yl)-8-nitro-2-piperazin-1-yl-[1]benzofuro[3,2-d]pyrimidine Traditional Name: 4-(1-methylimidazol-2-yl)-8-nitro-2-piperazino-benzofuro[3,2-d]pyrimidine Formula: C18H17N7O3 MolecularWeight: 379.37268

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C2=NC(=NC3=C2OC4=C3C=C(C=C4)[N+](=O)[O-])N5CCNCC5

Isomeric SMILES

CN1C=CN=C1C2=NC(=NC3=C2OC4=C3C=C(C=C4)[N+](=O)[O-])N5CCNCC5

InChI

InChI=1S/C18H17N7O3/c1-23-7-6-20-17(23)15-16-14(21-18(22-15)24-8-4-19-5-9-24)12-10-11(25(26)27)2-3-13(12)28-16/h2-3,6-7,10,19H,4-5,8-9H2,1H3