2-methyl-5-nitro-4-[(Z)-1-phenyl-1-pyrrolidin-1-yl-but-1-en-2-yl]-6-piperidin-1-yl-pyrimidine

Systemtic Name: 2-methyl-5-nitro-4-[(Z)-1-phenyl-1-pyrrolidin-1-yl-but-1-en-2-yl]-6-piperidin-1-yl-pyrimidine Openeye Name: 2-methyl-5-nitro-4-[(1Z)-1-[phenyl(pyrrolidin-1-yl)methylene]propyl]-6-(1-piperidyl)pyrimidine CAS Name: 2-methyl-5-nitro-4-[(Z)-1-phenyl-1-(1-pyrrolidinyl)but-1-en-2-yl]-6-(1-piperidinyl)pyrimidine IUPAC Name: 2-methyl-5-nitro-4-[(Z)-1-phenyl-1-pyrrolidin-1-ylbut-1-en-2-yl]-6-piperidin-1-ylpyrimidine Traditional Name: 4-[(Z)-1-ethyl-2-phenyl-2-pyrrolidino-vinyl]-2-methyl-5-nitro-6-piperidino-pyrimidine Formula: C24H31N5O2 MolecularWeight: 421.53524

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=CC=C1)N2CCCC2)C3=C(C(=NC(=N3)C)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC/C(=C(\C1=CC=CC=C1)/N2CCCC2)/C3=C(C(=NC(=N3)C)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C24H31N5O2/c1-3-20(22(27-14-10-11-15-27)19-12-6-4-7-13-19)21-23(29(30)31)24(26-18(2)25-21)28-16-8-5-9-17-28/h4,6-7,12-13H,3,5,8-11,14-17H2,1-2H3/b22-20-