N2-phenyl-6-prop-2-enylsulfanyl-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-phenyl-6-prop-2-enylsulfanyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-allylsulfanyl-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: N2-phenyl-6-(prop-2-enylthio)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-phenyl-6-prop-2-enylsulfanyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-(allylthio)-6-amino-s-triazin-2-yl]-phenyl-amine Formula: C12H13N5S MolecularWeight: 259.33012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC(=NC(=N1)NC2=CC=CC=C2)N

Isomeric SMILES

C=CCSC1=NC(=NC(=N1)NC2=CC=CC=C2)N

InChI

InChI=1S/C12H13N5S/c1-2-8-18-12-16-10(13)15-11(17-12)14-9-6-4-3-5-7-9/h2-7H,1,8H2,(H3,13,14,15,16,17)