N-[[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]methyl]-1-pyrrolidin-2-yl-propan-1-amine

Systemtic Name: N-[[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]methyl]-1-pyrrolidin-2-yl-propan-1-amine Openeye Name: N-[[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]methyl]-1-pyrrolidin-2-yl-propan-1-amine CAS Name: N-[[4-methyl-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinyl]methyl]-1-(2-pyrrolidinyl)-1-propanamine IUPAC Name: N-[[4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidin-5-yl]methyl]-1-pyrrolidin-2-ylpropan-1-amine Traditional Name: [4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]methyl-(1-pyrrolidin-2-ylpropyl)amine Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCCN1)NCC2=C(N=C(N=C2C)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC(C1CCCN1)NCC2=C(N=C(N=C2C)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H29N5O2/c1-3-22(23-13-8-14-26-23)27-16-21-17(2)28-25(18-9-5-4-6-10-18)29-24(21)19-11-7-12-20(15-19)30(31)32/h4-7,9-12,15,22-23,26-27H,3,8,13-14,16H2,1-2H3