6-(1,3-benzodioxol-5-ylmethylsulfanylmethyl)-N2-(4-methylphenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-(1,3-benzodioxol-5-ylmethylsulfanylmethyl)-N2-(4-methylphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-(1,3-benzodioxol-5-ylmethylsulfanylmethyl)-N2-(p-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[(1,3-benzodioxol-5-ylmethylthio)methyl]-N2-(4-methylphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-(1,3-benzodioxol-5-ylmethylsulfanylmethyl)-2-N-(4-methylphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(piperonylthio)methyl]-s-triazin-2-yl]-(p-tolyl)amine Formula: C19H19N5O2S MolecularWeight: 381.45146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H19N5O2S/c1-12-2-5-14(6-3-12)21-19-23-17(22-18(20)24-19)10-27-9-13-4-7-15-16(8-13)26-11-25-15/h2-8H,9-11H2,1H3,(H3,20,21,22,23,24)