1,1,4-tris(methylsulfanyl)-2,4-dinitro-but-1-ene

Systemtic Name: 1,1,4-tris(methylsulfanyl)-2,4-dinitro-but-1-ene Openeye Name: 1,1,4-tris(methylsulfanyl)-2,4-dinitro-but-1-ene CAS Name: 1,1,4-tris(methylthio)-2,4-dinitro-1-butene IUPAC Name: 1,1,4-tris(methylsulfanyl)-2,4-dinitrobut-1-ene Traditional Name: 1,1,4-tris(methylthio)-2,4-dinitro-but-1-ene Formula: C7H12N2O4S3 MolecularWeight: 284.37618

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CC(=C(SC)SC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CSC(CC(=C(SC)SC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H12N2O4S3/c1-14-6(9(12)13)4-5(8(10)11)7(15-2)16-3/h6H,4H2,1-3H3