1-[2,2-bis(chloranyl)-1-isothiocyanato-ethenyl]sulfonyl-4-chloranyl-benzene

Systemtic Name: 1-[2,2-bis(chloranyl)-1-isothiocyanato-ethenyl]sulfonyl-4-chloranyl-benzene Openeye Name: 1-chloro-4-(2,2-dichloro-1-isothiocyanato-vinyl)sulfonyl-benzene CAS Name: 1-chloro-4-(2,2-dichloro-1-isothiocyanatoethenyl)sulfonylbenzene IUPAC Name: 1-chloro-4-(2,2-dichloro-1-isothiocyanatoethenyl)sulfonylbenzene Traditional Name: 1-chloro-4-(2,2-dichloro-1-isothiocyanato-vinyl)sulfonyl-benzene Formula: C9H4Cl3NO2S2 MolecularWeight: 328.62256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)C(=C(Cl)Cl)N=C=S)Cl

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)C(=C(Cl)Cl)N=C=S)Cl

InChI

InChI=1S/C9H4Cl3NO2S2/c10-6-1-3-7(4-2-6)17(14,15)9(8(11)12)13-5-16/h1-4H