4-methyl-3-[2-(4-methylphenyl)sulfinylethyl]-2-(4-methylphenyl)sulfonyl-1H-pyrrole

Systemtic Name: 4-methyl-3-[2-(4-methylphenyl)sulfinylethyl]-2-(4-methylphenyl)sulfonyl-1H-pyrrole Openeye Name: 4-methyl-3-[2-(p-tolylsulfinyl)ethyl]-2-(p-tolylsulfonyl)-1H-pyrrole CAS Name: 4-methyl-3-[2-(4-methylphenyl)sulfinylethyl]-2-(4-methylphenyl)sulfonyl-1H-pyrrole IUPAC Name: 4-methyl-3-[2-(4-methylphenyl)sulfinylethyl]-2-(4-methylphenyl)sulfonyl-1H-pyrrole Traditional Name: 4-methyl-3-[2-(p-tolylsulfinyl)ethyl]-2-tosyl-1H-pyrrole Formula: C21H23NO3S2 MolecularWeight: 401.54222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)CCC2=C(NC=C2C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)CCC2=C(NC=C2C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H23NO3S2/c1-15-4-8-18(9-5-15)26(23)13-12-20-17(3)14-22-21(20)27(24,25)19-10-6-16(2)7-11-19/h4-11,14,22H,12-13H2,1-3H3