4-imidazol-1-yl-5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidine

Systemtic Name: 4-imidazol-1-yl-5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidine Openeye Name: 4-(4-benzyl-1-piperidyl)-6-imidazol-1-yl-5-nitro-pyrimidine CAS Name: 4-(1-imidazolyl)-5-nitro-6-[4-(phenylmethyl)-1-piperidinyl]pyrimidine IUPAC Name: 4-(4-benzylpiperidin-1-yl)-6-imidazol-1-yl-5-nitropyrimidine Traditional Name: 4-(4-benzylpiperidino)-6-imidazol-1-yl-5-nitro-pyrimidine Formula: C19H20N6O2 MolecularWeight: 364.4011

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])N4C=CN=C4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])N4C=CN=C4

InChI

InChI=1S/C19H20N6O2/c26-25(27)17-18(21-13-22-19(17)24-11-8-20-14-24)23-9-6-16(7-10-23)12-15-4-2-1-3-5-15/h1-5,8,11,13-14,16H,6-7,9-10,12H2