2-[[1-(4-methylphenyl)sulfonylpyrrol-2-yl]methyl]benzotriazole

Systemtic Name: 2-[[1-(4-methylphenyl)sulfonylpyrrol-2-yl]methyl]benzotriazole Openeye Name: 2-[[1-(p-tolylsulfonyl)pyrrol-2-yl]methyl]benzotriazole CAS Name: 2-[[1-(4-methylphenyl)sulfonyl-2-pyrrolyl]methyl]benzotriazole IUPAC Name: 2-[[1-(4-methylphenyl)sulfonylpyrrol-2-yl]methyl]benzotriazole Traditional Name: 2-[(1-tosylpyrrol-2-yl)methyl]benzotriazole Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2CN3N=C4C=CC=CC4=N3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2CN3N=C4C=CC=CC4=N3

InChI

InChI=1S/C18H16N4O2S/c1-14-8-10-16(11-9-14)25(23,24)21-12-4-5-15(21)13-22-19-17-6-2-3-7-18(17)20-22/h2-12H,13H2,1H3