6-[[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[[[1-(4-methoxyphenyl)-2-benzimidazolyl]thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[[1-(4-methoxyphenyl)benzimidazol-2-yl]thio]methyl]-s-triazin-2-yl]amine Formula: C18H17N7OS MolecularWeight: 379.43888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=NC(=NC(=N4)N)N

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=NC(=NC(=N4)N)N

InChI

InChI=1S/C18H17N7OS/c1-26-12-8-6-11(7-9-12)25-14-5-3-2-4-13(14)21-18(25)27-10-15-22-16(19)24-17(20)23-15/h2-9H,10H2,1H3,(H4,19,20,22,23,24)