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

Systemtic Name: 6-(1,3-benzodioxol-5-ylmethylsulfanylmethyl)-N2-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-(1,3-benzodioxol-5-ylmethylsulfanylmethyl)-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[(1,3-benzodioxol-5-ylmethylthio)methyl]-N2-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-(1,3-benzodioxol-5-ylmethylsulfanylmethyl)-2-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(piperonylthio)methyl]-s-triazin-2-yl]-phenyl-amine Formula: C18H17N5O2S MolecularWeight: 367.42488

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CSCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CSCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

InChI

InChI=1S/C18H17N5O2S/c19-17-21-16(22-18(23-17)20-13-4-2-1-3-5-13)10-26-9-12-6-7-14-15(8-12)25-11-24-14/h1-8H,9-11H2,(H3,19,20,21,22,23)