4-chloranyl-N2,N2,N6,4-tetrakis(pentylsulfanyl)-1H-1,3,5-triazine-2,6-diamine

Systemtic Name: 4-chloranyl-N2,N2,N6,4-tetrakis(pentylsulfanyl)-1H-1,3,5-triazine-2,6-diamine Openeye Name: 4-chloro-N2,N2,N6,4-tetrakis(pentylsulfanyl)-1H-1,3,5-triazine-2,6-diamine CAS Name: N-[6-[bis(pentylthio)amino]-4-chloro-4-(pentylthio)-1H-1,3,5-triazin-2-yl]-1-pentanesulfenamide IUPAC Name: 4-chloro-2-N,2-N,6-N,4-tetrakis(pentylsulfanyl)-1H-1,3,5-triazine-2,6-diamine Traditional Name: bis(amylthio)-[4-(amylthio)-6-[(amylthio)amino]-4-chloro-1H-s-triazin-2-yl]amine Formula: C23H46ClN5S4 MolecularWeight: 556.35784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1(N=C(NC(=N1)N(SCCCCC)SCCCCC)NSCCCCC)Cl

Isomeric SMILES

CCCCCSC1(N=C(NC(=N1)N(SCCCCC)SCCCCC)NSCCCCC)Cl

InChI

InChI=1S/C23H46ClN5S4/c1-5-9-13-17-30-23(24)26-21(28-31-18-14-10-6-2)25-22(27-23)29(32-19-15-11-7-3)33-20-16-12-8-4/h5-20H2,1-4H3,(H2,25,26,27,28)