N2-[4-[bis(2-azanylethylsulfanyl)arsanyl]phenyl]-1,3,5-triazine-2,4,6-triamine dihydrochloride

Systemtic Name: N2-[4-[bis(2-azanylethylsulfanyl)arsanyl]phenyl]-1,3,5-triazine-2,4,6-triamine dihydrochloride Openeye Name: N2-[4-[bis(2-aminoethylsulfanyl)arsanyl]phenyl]-1,3,5-triazine-2,4,6-triamine dihydrochloride CAS Name: N2-[4-bis(2-aminoethylthio)arsinophenyl]-1,3,5-triazine-2,4,6-triamine dihydrochloride IUPAC Name: 2-N-[4-[bis(2-aminoethylsulfanyl)arsanyl]phenyl]-1,3,5-triazine-2,4,6-triamine dihydrochloride Traditional Name: [4-bis(2-aminoethylthio)arsinophenyl]-(4,6-diamino-s-triazin-2-yl)amine dihydrochloride Formula: C13H23AsCl2N8S2 MolecularWeight: 501.33292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC(=NC(=N2)N)N)[As](SCCN)SCCN.Cl.Cl

Isomeric SMILES

C1=CC(=CC=C1NC2=NC(=NC(=N2)N)N)[As](SCCN)SCCN.Cl.Cl

InChI

InChI=1S/C13H21AsN8S2.2ClH/c15-5-7-23-14(24-8-6-16)9-1-3-10(4-2-9)19-13-21-11(17)20-12(18)22-13;;/h1-4H,5-8,15-16H2,(H5,17,18,19,20,21,22);2*1H