N6-[(4-chlorophenyl)methyl]-N4-naphthalen-1-yl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-[(4-chlorophenyl)methyl]-N4-naphthalen-1-yl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-[(4-chlorophenyl)methyl]-N4-(1-naphthyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-[(4-chlorophenyl)methyl]-N4-(1-naphthalenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-[(4-chlorophenyl)methyl]-4-N-naphthalen-1-yl-5-nitropyrimidine-4,6-diamine Traditional Name: (4-chlorobenzyl)-[6-(1-naphthylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C21H16ClN5O2 MolecularWeight: 405.83704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC3=C(C(=NC=N3)NCC4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC3=C(C(=NC=N3)NCC4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H16ClN5O2/c22-16-10-8-14(9-11-16)12-23-20-19(27(28)29)21(25-13-24-20)26-18-7-3-5-15-4-1-2-6-17(15)18/h1-11,13H,12H2,(H2,23,24,25,26)