N2-butyl-6-(pyridin-2-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-butyl-6-(pyridin-2-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine Openeye Name: N2-butyl-6-(2-pyridylsulfanylmethyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-butyl-6-[(2-pyridinylthio)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-butyl-6-(pyridin-2-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(2-pyridylthio)methyl]-s-triazin-2-yl]-butyl-amine Formula: C13H18N6S MolecularWeight: 290.38722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=NC(=N1)N)CSC2=CC=CC=N2

Isomeric SMILES

CCCCNC1=NC(=NC(=N1)N)CSC2=CC=CC=N2

InChI

InChI=1S/C13H18N6S/c1-2-3-7-16-13-18-10(17-12(14)19-13)9-20-11-6-4-5-8-15-11/h4-6,8H,2-3,7,9H2,1H3,(H3,14,16,17,18,19)