1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N-[(4-nitrophenyl)methyl]piperidine-2-carboxamide

Systemtic Name: 1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N-[(4-nitrophenyl)methyl]piperidine-2-carboxamide Openeye Name: 1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N-[(4-nitrophenyl)methyl]piperidine-2-carboxamide CAS Name: 1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-N-[(4-nitrophenyl)methyl]-2-piperidinecarboxamide IUPAC Name: 1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)-N-[(4-nitrophenyl)methyl]piperidine-2-carboxamide Traditional Name: 1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N-(4-nitrobenzyl)pipecolinamide Formula: C21H23N7O3 MolecularWeight: 421.45242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCCCC3C(=O)NCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCCCC3C(=O)NCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H23N7O3/c1-15-12-19(25-21(24-15)26-11-9-22-14-26)27-10-3-2-4-18(27)20(29)23-13-16-5-7-17(8-6-16)28(30)31/h5-9,11-12,14,18H,2-4,10,13H2,1H3,(H,23,29)