N2-[3-(3-nitrophenyl)phenyl]-N4-(3-piperidin-1-ylpropyl)pyrimidine-2,4-diamine

Systemtic Name: N2-[3-(3-nitrophenyl)phenyl]-N4-(3-piperidin-1-ylpropyl)pyrimidine-2,4-diamine Openeye Name: N2-[3-(3-nitrophenyl)phenyl]-N4-[3-(1-piperidyl)propyl]pyrimidine-2,4-diamine CAS Name: N2-[3-(3-nitrophenyl)phenyl]-N4-[3-(1-piperidinyl)propyl]pyrimidine-2,4-diamine IUPAC Name: 2-N-[3-(3-nitrophenyl)phenyl]-4-N-(3-piperidin-1-ylpropyl)pyrimidine-2,4-diamine Traditional Name: [2-[3-(3-nitrophenyl)anilino]pyrimidin-4-yl]-(3-piperidinopropyl)amine Formula: C24H28N6O2 MolecularWeight: 432.51812

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNC2=NC(=NC=C2)NC3=CC=CC(=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CCCNC2=NC(=NC=C2)NC3=CC=CC(=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H28N6O2/c31-30(32)22-10-5-8-20(18-22)19-7-4-9-21(17-19)27-24-26-13-11-23(28-24)25-12-6-16-29-14-2-1-3-15-29/h4-5,7-11,13,17-18H,1-3,6,12,14-16H2,(H2,25,26,27,28)