3-ethynyl-5-methyl-2-(4-methylsulfonylphenyl)-1H-pyrrole

Systemtic Name: 3-ethynyl-5-methyl-2-(4-methylsulfonylphenyl)-1H-pyrrole Openeye Name: 3-ethynyl-5-methyl-2-(4-methylsulfonylphenyl)-1H-pyrrole CAS Name: 3-ethynyl-5-methyl-2-(4-methylsulfonylphenyl)-1H-pyrrole IUPAC Name: 3-ethynyl-5-methyl-2-(4-methylsulfonylphenyl)-1H-pyrrole Traditional Name: 3-ethynyl-2-(4-mesylphenyl)-5-methyl-1H-pyrrole Formula: C14H13NO2S MolecularWeight: 259.32352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C2=CC=C(C=C2)S(=O)(=O)C)C#C

Isomeric SMILES

CC1=CC(=C(N1)C2=CC=C(C=C2)S(=O)(=O)C)C#C

InChI

InChI=1S/C14H13NO2S/c1-4-11-9-10(2)15-14(11)12-5-7-13(8-6-12)18(3,16)17/h1,5-9,15H,2-3H3