N6-cycloheptyl-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N6-cycloheptyl-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N4,N4-dibenzyl-N6-cycloheptyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-cycloheptyl-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-dibenzyl-6-N-cycloheptyl-5-nitropyrimidine-4,6-diamine Traditional Name: dibenzyl-[6-(cycloheptylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=C(C(=NC=N2)N(CC3=CC=CC=C3)CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCCC(CC1)NC2=C(C(=NC=N2)N(CC3=CC=CC=C3)CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H29N5O2/c31-30(32)23-24(28-22-15-9-1-2-10-16-22)26-19-27-25(23)29(17-20-11-5-3-6-12-20)18-21-13-7-4-8-14-21/h3-8,11-14,19,22H,1-2,9-10,15-18H2,(H,26,27,28)