2-[[1-(4-methylphenyl)sulfonylpyrrol-3-yl]methyl]aniline

Systemtic Name: 2-[[1-(4-methylphenyl)sulfonylpyrrol-3-yl]methyl]aniline Openeye Name: 2-[[1-(p-tolylsulfonyl)pyrrol-3-yl]methyl]aniline CAS Name: 2-[[1-(4-methylphenyl)sulfonyl-3-pyrrolyl]methyl]aniline IUPAC Name: 2-[[1-(4-methylphenyl)sulfonylpyrrol-3-yl]methyl]aniline Traditional Name: [2-[(1-tosylpyrrol-3-yl)methyl]phenyl]amine Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)CC3=CC=CC=C3N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)CC3=CC=CC=C3N

InChI

InChI=1S/C18H18N2O2S/c1-14-6-8-17(9-7-14)23(21,22)20-11-10-15(13-20)12-16-4-2-3-5-18(16)19/h2-11,13H,12,19H2,1H3