N6-cyclopentyl-5-nitro-2-phenyl-N4-(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N6-cyclopentyl-5-nitro-2-phenyl-N4-(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N4-benzyl-N6-cyclopentyl-5-nitro-2-phenyl-pyrimidine-4,6-diamine CAS Name: N6-cyclopentyl-5-nitro-2-phenyl-N4-(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-6-N-cyclopentyl-5-nitro-2-phenylpyrimidine-4,6-diamine Traditional Name: benzyl-[6-(cyclopentylamino)-5-nitro-2-phenyl-pyrimidin-4-yl]amine Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=C(C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)NC2=C(C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O2/c28-27(29)19-21(23-15-16-9-3-1-4-10-16)25-20(17-11-5-2-6-12-17)26-22(19)24-18-13-7-8-14-18/h1-6,9-12,18H,7-8,13-15H2,(H2,23,24,25,26)