4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]sulfonylaniline

Systemtic Name: 4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]sulfonylaniline Openeye Name: 4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]sulfonylaniline CAS Name: 4-[4-(2,5-dimethyl-1-pyrrolyl)phenyl]sulfonylaniline IUPAC Name: 4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]sulfonylaniline Traditional Name: [4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]sulfonylphenyl]amine Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)N)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)N)C

InChI

InChI=1S/C18H18N2O2S/c1-13-3-4-14(2)20(13)16-7-11-18(12-8-16)23(21,22)17-9-5-15(19)6-10-17/h3-12H,19H2,1-2H3