5-nitro-6-[(E)-2-phenylethenyl]-N2,N4-bis(phenylmethyl)pyrimidine-2,4-diamine

Systemtic Name: 5-nitro-6-[(E)-2-phenylethenyl]-N2,N4-bis(phenylmethyl)pyrimidine-2,4-diamine Openeye Name: N2,N4-dibenzyl-5-nitro-6-[(E)-styryl]pyrimidine-2,4-diamine CAS Name: 5-nitro-6-[(E)-2-phenylethenyl]-N2,N4-bis(phenylmethyl)pyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-dibenzyl-5-nitro-6-[(E)-2-phenylethenyl]pyrimidine-2,4-diamine Traditional Name: benzyl-[2-(benzylamino)-5-nitro-6-[(E)-styryl]pyrimidin-4-yl]amine Formula: C26H23N5O2 MolecularWeight: 437.49312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NC(=C2[N+](=O)[O-])C=CC3=CC=CC=C3)NCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NC(=C2[N+](=O)[O-])/C=C/C3=CC=CC=C3)NCC4=CC=CC=C4

InChI

InChI=1S/C26H23N5O2/c32-31(33)24-23(17-16-20-10-4-1-5-11-20)29-26(28-19-22-14-8-3-9-15-22)30-25(24)27-18-21-12-6-2-7-13-21/h1-17H,18-19H2,(H2,27,28,29,30)/b17-16+