2-butylsulfanyl-1,3-benzothiazole-6-sulfonyl chloride

Systemtic Name: 2-butylsulfanyl-1,3-benzothiazole-6-sulfonyl chloride Openeye Name: 2-butylsulfanyl-1,3-benzothiazole-6-sulfonyl chloride CAS Name: 2-(butylthio)-1,3-benzothiazole-6-sulfonyl chloride IUPAC Name: 2-butylsulfanyl-1,3-benzothiazole-6-sulfonyl chloride Traditional Name: 2-(butylthio)-1,3-benzothiazole-6-sulfonyl chloride Formula: C11H12ClNO2S3 MolecularWeight: 321.86648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)Cl

Isomeric SMILES

CCCCSC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)Cl

InChI

InChI=1S/C11H12ClNO2S3/c1-2-3-6-16-11-13-9-5-4-8(18(12,14)15)7-10(9)17-11/h4-5,7H,2-3,6H2,1H3