6-methyl-N4-[(E)-(3-nitrophenyl)methylideneamino]-N2-(phenylmethyl)pyrimidine-2,4-diamine

Systemtic Name: 6-methyl-N4-[(E)-(3-nitrophenyl)methylideneamino]-N2-(phenylmethyl)pyrimidine-2,4-diamine Openeye Name: N2-benzyl-6-methyl-N4-[(E)-(3-nitrophenyl)methyleneamino]pyrimidine-2,4-diamine CAS Name: 6-methyl-N4-[(E)-(3-nitrophenyl)methylideneamino]-N2-(phenylmethyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-benzyl-6-methyl-4-N-[(E)-(3-nitrophenyl)methylideneamino]pyrimidine-2,4-diamine Traditional Name: benzyl-[4-methyl-6-[(N'E)-N'-(3-nitrobenzylidene)hydrazino]pyrimidin-2-yl]amine Formula: C19H18N6O2 MolecularWeight: 362.38522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NCC2=CC=CC=C2)NN=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)NCC2=CC=CC=C2)N/N=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N6O2/c1-14-10-18(23-19(22-14)20-12-15-6-3-2-4-7-15)24-21-13-16-8-5-9-17(11-16)25(26)27/h2-11,13H,12H2,1H3,(H2,20,22,23,24)/b21-13+