5-bromanyl-2-[2-methylpropoxy(methylsulfanyl)phosphinothioyl]oxy-benzenecarbonitrile

Systemtic Name: 5-bromanyl-2-[2-methylpropoxy(methylsulfanyl)phosphinothioyl]oxy-benzenecarbonitrile Openeye Name: 5-bromo-2-[isobutoxy(methylsulfanyl)phosphinothioyl]oxy-benzonitrile CAS Name: 5-bromo-2-[2-methylpropoxy-(methylthio)phosphinothioyl]oxybenzonitrile IUPAC Name: 5-bromo-2-[2-methylpropoxy(methylsulfanyl)phosphinothioyl]oxybenzonitrile Traditional Name: 5-bromo-2-[isobutoxy-(methylthio)thiophosphoryl]oxy-benzonitrile Formula: C12H15BrNO2PS2 MolecularWeight: 380.260761

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COP(=S)(OC1=C(C=C(C=C1)Br)C#N)SC

Isomeric SMILES

CC(C)COP(=S)(OC1=C(C=C(C=C1)Br)C#N)SC

InChI

InChI=1S/C12H15BrNO2PS2/c1-9(2)8-15-17(18,19-3)16-12-5-4-11(13)6-10(12)7-14/h4-6,9H,8H2,1-3H3