N4,N6-bis[[5-(4-chlorophenyl)furan-2-yl]methyl]-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4,N6-bis[[5-(4-chlorophenyl)furan-2-yl]methyl]-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4,N6-bis[[5-(4-chlorophenyl)-2-furyl]methyl]-5-nitro-pyrimidine-4,6-diamine CAS Name: N4,N6-bis[[5-(4-chlorophenyl)-2-furanyl]methyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N,6-N-bis[[5-(4-chlorophenyl)furan-2-yl]methyl]-5-nitropyrimidine-4,6-diamine Traditional Name: [5-(4-chlorophenyl)-2-furyl]methyl-[6-[[5-(4-chlorophenyl)-2-furyl]methylamino]-5-nitro-pyrimidin-4-yl]amine Formula: C26H19Cl2N5O4 MolecularWeight: 536.36616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(O2)CNC3=C(C(=NC=N3)NCC4=CC=C(O4)C5=CC=C(C=C5)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(O2)CNC3=C(C(=NC=N3)NCC4=CC=C(O4)C5=CC=C(C=C5)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C26H19Cl2N5O4/c27-18-5-1-16(2-6-18)22-11-9-20(36-22)13-29-25-24(33(34)35)26(32-15-31-25)30-14-21-10-12-23(37-21)17-3-7-19(28)8-4-17/h1-12,15H,13-14H2,(H2,29,30,31,32)