N2-(2-ethylphenyl)-6-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(2-ethylphenyl)-6-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-(2-ethylphenyl)-6-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-(2-ethylphenyl)-6-[[(1-oxido-2-pyridin-1-iumyl)thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(2-ethylphenyl)-6-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(1-oxidopyridin-1-ium-2-yl)thio]methyl]-s-triazin-2-yl]-(2-ethylphenyl)amine Formula: C17H18N6OS MolecularWeight: 354.42942

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C17H18N6OS/c1-2-12-7-3-4-8-13(12)19-17-21-14(20-16(18)22-17)11-25-15-9-5-6-10-23(15)24/h3-10H,2,11H2,1H3,(H3,18,19,20,21,22)