4,6-bis(chloranyl)-1-benzothiophene; 1-chloranyl-3-(2,2-diethoxyethylsulfanyl)benzene

Systemtic Name: 4,6-bis(chloranyl)-1-benzothiophene; 1-chloranyl-3-(2,2-diethoxyethylsulfanyl)benzene Openeye Name: 1-chloro-3-(2,2-diethoxyethylsulfanyl)benzene; 4,6-dichlorobenzothiophene CAS Name: 1-chloro-3-(2,2-diethoxyethylthio)benzene; 4,6-dichloro-1-benzothiophene IUPAC Name: 1-chloro-3-(2,2-diethoxyethylsulfanyl)benzene; 4,6-dichloro-1-benzothiophene Traditional Name: 1-chloro-3-(2,2-diethoxyethylthio)benzene; 4,6-dichlorobenzothiophene Formula: C20H21Cl3O2S2 MolecularWeight: 463.86854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CSC1=CC(=CC=C1)Cl)OCC.C1=CSC2=CC(=CC(=C21)Cl)Cl

Isomeric SMILES

CCOC(CSC1=CC(=CC=C1)Cl)OCC.C1=CSC2=CC(=CC(=C21)Cl)Cl

InChI

InChI=1S/C12H17ClO2S.C8H4Cl2S/c1-3-14-12(15-4-2)9-16-11-7-5-6-10(13)8-11;9-5-3-7(10)6-1-2-11-8(6)4-5/h5-8,12H,3-4,9H2,1-2H3;1-4H