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5-[[azanyl-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-2-nitro-thiophene-3-carbonitrile

5-[[azanyl-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-2-nitro-thiophene-3-carbonitrile

Systemtic Name:5-[[azanyl-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-2-nitro-thiophene-3-carbonitrile
Openeye Name:5-[[amino-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-2-nitro-thiophene-3-carbonitrile
CAS Name:5-[[amino-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-2-nitro-3-thiophenecarbonitrile
IUPAC Name:5-[[amino-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-2-nitrothiophene-3-carbonitrile
Traditional Name:5-[[amino-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-2-nitro-thiophene-3-carbonitrile
Formula: C10H13Br2N4O4PS
MolecularWeight: 476.081381
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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1C#N)[N+](=O)[O-])COP(=O)(N)N(CCBr)CCBr


Isomeric SMILES

C1=C(SC(=C1C#N)[N+](=O)[O-])COP(=O)(N)N(CCBr)CCBr


InChI

InChI=1S/C10H13Br2N4O4PS/c11-1-3-15(4-2-12)21(14,19)20-7-9-5-8(6-13)10(22-9)16(17)18/h5H,1-4,7H2,(H2,14,19)


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