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

Systemtic Name: 6-[(1-phenethylbenzimidazol-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(1-phenethylbenzimidazol-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(1-phenethyl-2-benzimidazolyl)thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(1-phenethylbenzimidazol-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(1-phenethylbenzimidazol-2-yl)thio]methyl]-s-triazin-2-yl]amine Formula: C19H19N7S MolecularWeight: 377.46606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=CC=CC=C3N=C2SCC4=NC(=NC(=N4)N)N

Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=CC=CC=C3N=C2SCC4=NC(=NC(=N4)N)N

InChI

InChI=1S/C19H19N7S/c20-17-23-16(24-18(21)25-17)12-27-19-22-14-8-4-5-9-15(14)26(19)11-10-13-6-2-1-3-7-13/h1-9H,10-12H2,(H4,20,21,23,24,25)