(3-azanyl-2-bromanyl-3-oxidanylidene-propyl)sulfanyl-(1-pentadecoxypentadecylsulfanyl)-sulfanylidene-phosphanium

Systemtic Name: (3-azanyl-2-bromanyl-3-oxidanylidene-propyl)sulfanyl-(1-pentadecoxypentadecylsulfanyl)-sulfanylidene-phosphanium Openeye Name: (3-amino-2-bromo-3-oxo-propyl)sulfanyl-(1-pentadecoxypentadecylsulfanyl)-thioxo-phosphonium CAS Name: [(3-amino-2-bromo-3-oxopropyl)thio]-(1-pentadecoxypentadecylthio)-sulfanylidenephosphonium IUPAC Name: (3-amino-2-bromo-3-oxopropyl)sulfanyl-(1-pentadecoxypentadecylsulfanyl)-sulfanylidenephosphanium Traditional Name: [(3-amino-2-bromo-3-keto-propyl)thio]-(1-pentadecoxypentadecylthio)-thioxo-phosphonium Formula: C33H66BrNO2PS3+ MolecularWeight: 715.955401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC(CCCCCCCCCCCCCC)S[P+](=S)SCC(C(=O)N)Br

Isomeric SMILES

CCCCCCCCCCCCCCCOC(CCCCCCCCCCCCCC)S[P+](=S)SCC(C(=O)N)Br

InChI

InChI=1S/C33H65BrNO2PS3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37-32(41-38(39)40-30-31(34)33(35)36)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-32H,3-30H2,1-2H3,(H-,35,36)/p+1