6-(1H-benzimidazol-2-ylsulfanyl)-N4-(4-methoxyphenyl)-N2-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-(1H-benzimidazol-2-ylsulfanyl)-N4-(4-methoxyphenyl)-N2-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-(1H-benzimidazol-2-ylsulfanyl)-N4-(4-methoxyphenyl)-N2-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-(1H-benzimidazol-2-ylthio)-N4-(4-methoxyphenyl)-N2-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-(1H-benzimidazol-2-ylsulfanyl)-4-N-(4-methoxyphenyl)-2-N-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-(1H-benzimidazol-2-ylthio)-6-(3-nitroanilino)-s-triazin-2-yl]-(4-methoxyphenyl)amine Formula: C23H18N8O3S MolecularWeight: 486.50582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=NC(=N2)SC3=NC4=CC=CC=C4N3)NC5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=NC(=N2)SC3=NC4=CC=CC=C4N3)NC5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H18N8O3S/c1-34-17-11-9-14(10-12-17)24-20-28-21(25-15-5-4-6-16(13-15)31(32)33)30-23(29-20)35-22-26-18-7-2-3-8-19(18)27-22/h2-13H,1H3,(H,26,27)(H2,24,25,28,29,30)