N4-(furan-2-ylmethyl)-5-nitro-2-piperidin-1-yl-pyrimidine-4,6-diamine

Systemtic Name: N4-(furan-2-ylmethyl)-5-nitro-2-piperidin-1-yl-pyrimidine-4,6-diamine Openeye Name: N4-(2-furylmethyl)-5-nitro-2-(1-piperidyl)pyrimidine-4,6-diamine CAS Name: N4-(2-furanylmethyl)-5-nitro-2-(1-piperidinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-(furan-2-ylmethyl)-5-nitro-2-piperidin-1-ylpyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-2-piperidino-pyrimidin-4-yl)-(2-furfuryl)amine Formula: C14H18N6O3 MolecularWeight: 318.33112

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=C(C(=N2)NCC3=CC=CO3)[N+](=O)[O-])N

Isomeric SMILES

C1CCN(CC1)C2=NC(=C(C(=N2)NCC3=CC=CO3)[N+](=O)[O-])N

InChI

InChI=1S/C14H18N6O3/c15-12-11(20(21)22)13(16-9-10-5-4-8-23-10)18-14(17-12)19-6-2-1-3-7-19/h4-5,8H,1-3,6-7,9H2,(H3,15,16,17,18)