6-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-N2-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-2-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-s-triazin-2-yl]-phenyl-amine Formula: C18H17N7OS MolecularWeight: 379.43888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

InChI

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