5-(3-methylbutylsulfonylmethyl)-1-benzothiophene

Systemtic Name: 5-(3-methylbutylsulfonylmethyl)-1-benzothiophene Openeye Name: 5-(isopentylsulfonylmethyl)benzothiophene CAS Name: 5-(3-methylbutylsulfonylmethyl)-1-benzothiophene IUPAC Name: 5-(3-methylbutylsulfonylmethyl)-1-benzothiophene Traditional Name: 5-(isoamylsulfonylmethyl)benzothiophene Formula: C14H18O2S2 MolecularWeight: 282.42152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCS(=O)(=O)CC1=CC2=C(C=C1)SC=C2

Isomeric SMILES

CC(C)CCS(=O)(=O)CC1=CC2=C(C=C1)SC=C2

InChI

InChI=1S/C14H18O2S2/c1-11(2)6-8-18(15,16)10-12-3-4-14-13(9-12)5-7-17-14/h3-5,7,9,11H,6,8,10H2,1-2H3