3-[bis(phenylsulfonyl)methyl]-1-benzothiophene

Systemtic Name: 3-[bis(phenylsulfonyl)methyl]-1-benzothiophene Openeye Name: 3-[bis(benzenesulfonyl)methyl]benzothiophene CAS Name: 3-[bis(benzenesulfonyl)methyl]-1-benzothiophene IUPAC Name: 3-[bis(benzenesulfonyl)methyl]-1-benzothiophene Traditional Name: 3-(dibesylmethyl)benzothiophene Formula: C21H16O4S3 MolecularWeight: 428.54434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C(C2=CSC3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C(C2=CSC3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H16O4S3/c22-27(23,16-9-3-1-4-10-16)21(28(24,25)17-11-5-2-6-12-17)19-15-26-20-14-8-7-13-18(19)20/h1-15,21H