3-(phenylmethyl)-6-(phenylmethylsulfanyl)-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium

Systemtic Name: 3-(phenylmethyl)-6-(phenylmethylsulfanyl)-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium Openeye Name: 3-benzyl-6-benzylsulfanyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium CAS Name: 3-(phenylmethyl)-6-(phenylmethylthio)-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium IUPAC Name: 3-benzyl-6-benzylsulfanyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium Traditional Name: 3-benzyl-6-(benzylthio)-1,2,3,4-tetrahydro-s-triazin-3-ium Formula: C17H20N3S+ MolecularWeight: 298.4258

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Descriptors Computed from Structure

Canonical SMILES:

C1NC(=NC[NH+]1CC2=CC=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

C1NC(=NC[NH+]1CC2=CC=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C17H19N3S/c1-3-7-15(8-4-1)11-20-13-18-17(19-14-20)21-12-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,18,19)/p+1