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

Systemtic Name: 6-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(6-ethoxy-1H-benzimidazol-2-yl)thio]methyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-2-N-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(6-ethoxy-1H-benzimidazol-2-yl)thio]methyl]-s-triazin-2-yl]-(2-methoxyphenyl)amine Formula: C20H21N7O2S MolecularWeight: 423.49144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N2)SCC3=NC(=NC(=N3)NC4=CC=CC=C4OC)N

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N2)SCC3=NC(=NC(=N3)NC4=CC=CC=C4OC)N

InChI

InChI=1S/C20H21N7O2S/c1-3-29-12-8-9-13-15(10-12)24-20(23-13)30-11-17-25-18(21)27-19(26-17)22-14-6-4-5-7-16(14)28-2/h4-10H,3,11H2,1-2H3,(H,23,24)(H3,21,22,25,26,27)