3-[isocyano-(4-methylphenyl)sulfonyl-methyl]thiophene

Systemtic Name: 3-[isocyano-(4-methylphenyl)sulfonyl-methyl]thiophene Openeye Name: 3-[isocyano(p-tolylsulfonyl)methyl]thiophene CAS Name: 3-[isocyano-(4-methylphenyl)sulfonylmethyl]thiophene IUPAC Name: 3-[isocyano-(4-methylphenyl)sulfonylmethyl]thiophene Traditional Name: 3-[isocyano(tosyl)methyl]thiophene Formula: C13H11NO2S2 MolecularWeight: 277.36194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C2=CSC=C2)[N+]#[C-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C2=CSC=C2)[N+]#[C-]

InChI

InChI=1S/C13H11NO2S2/c1-10-3-5-12(6-4-10)18(15,16)13(14-2)11-7-8-17-9-11/h3-9,13H,1H3