1-(1-ethylpiperidin-3-yl)-3-[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]urea

Systemtic Name: 1-(1-ethylpiperidin-3-yl)-3-[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]urea Openeye Name: 1-(1-ethyl-3-piperidyl)-3-[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]urea CAS Name: 1-(1-ethyl-3-piperidinyl)-3-[4-methyl-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinyl]urea IUPAC Name: 1-(1-ethylpiperidin-3-yl)-3-[4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidin-5-yl]urea Traditional Name: 1-(1-ethyl-3-piperidyl)-3-[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]urea Formula: C25H28N6O3 MolecularWeight: 460.52822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(C1)NC(=O)NC2=C(N=C(N=C2C)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCN1CCCC(C1)NC(=O)NC2=C(N=C(N=C2C)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H28N6O3/c1-3-30-14-8-12-20(16-30)27-25(32)29-22-17(2)26-24(18-9-5-4-6-10-18)28-23(22)19-11-7-13-21(15-19)31(33)34/h4-7,9-11,13,15,20H,3,8,12,14,16H2,1-2H3,(H2,27,29,32)