N-[(4-methylphenyl)methyl]-5-nitro-6-[2-(4-nitrophenyl)hydrazinyl]pyrimidin-4-amine

Systemtic Name: N-[(4-methylphenyl)methyl]-5-nitro-6-[2-(4-nitrophenyl)hydrazinyl]pyrimidin-4-amine Openeye Name: 5-nitro-6-[2-(4-nitrophenyl)hydrazino]-N-(p-tolylmethyl)pyrimidin-4-amine CAS Name: N-[(4-methylphenyl)methyl]-5-nitro-6-[(4-nitrophenyl)hydrazo]-4-pyrimidinamine IUPAC Name: N-[(4-methylphenyl)methyl]-5-nitro-6-[2-(4-nitrophenyl)hydrazinyl]pyrimidin-4-amine Traditional Name: (4-methylbenzyl)-[5-nitro-6-[N'-(4-nitrophenyl)hydrazino]pyrimidin-4-yl]amine Formula: C18H17N7O4 MolecularWeight: 395.37208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C(C(=NC=N2)NNC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C(C(=NC=N2)NNC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H17N7O4/c1-12-2-4-13(5-3-12)10-19-17-16(25(28)29)18(21-11-20-17)23-22-14-6-8-15(9-7-14)24(26)27/h2-9,11,22H,10H2,1H3,(H2,19,20,21,23)