N-[3,8-dimethyl-7-(5-nitrofuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]-1-methyl-piperidin-2-imine

Systemtic Name: N-[3,8-dimethyl-7-(5-nitrofuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]-1-methyl-piperidin-2-imine Openeye Name: N-[3,8-dimethyl-7-(5-nitro-2-furyl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]-1-methyl-piperidin-2-imine CAS Name: N-[3,8-dimethyl-7-(5-nitro-2-furanyl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]-1-methyl-2-piperidinimine IUPAC Name: N-[3,8-dimethyl-7-(5-nitrofuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]-1-methylpiperidin-2-imine Traditional Name: (Z)-[3,8-dimethyl-7-(5-nitro-2-furyl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]-(1-methyl-2-piperidylidene)amine Formula: C17H19N7O3 MolecularWeight: 369.37786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N2C1=NN=C2C)N=C3CCCCN3C)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=C(N2C1=NN=C2C)/N=C\3/CCCCN3C)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C17H19N7O3/c1-10-15(12-7-8-14(27-12)24(25)26)19-17(23-11(2)20-21-16(10)23)18-13-6-4-5-9-22(13)3/h7-8H,4-6,9H2,1-3H3/b18-13-