N-(3-ethylpiperidin-1-yl)-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide

Systemtic Name: N-(3-ethylpiperidin-1-yl)-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide Openeye Name: N-(3-ethyl-1-piperidyl)-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide CAS Name: N-(3-ethyl-1-piperidinyl)-4-methyl-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinecarboxamide IUPAC Name: N-(3-ethylpiperidin-1-yl)-4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidine-5-carboxamide Traditional Name: N-(3-ethylpiperidino)-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide Formula: C25H27N5O3 MolecularWeight: 445.51358

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCN(C1)NC(=O)C2=C(N=C(N=C2C)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCN(C1)NC(=O)C2=C(N=C(N=C2C)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H27N5O3/c1-3-18-9-8-14-29(16-18)28-25(31)22-17(2)26-24(19-10-5-4-6-11-19)27-23(22)20-12-7-13-21(15-20)30(32)33/h4-7,10-13,15,18H,3,8-9,14,16H2,1-2H3,(H,28,31)