N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-4-(methylsulfonylmethyl)benzamide

Systemtic Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-4-(methylsulfonylmethyl)benzamide Openeye Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-4-(methylsulfonylmethyl)benzamide CAS Name: N-[4-(2,5-dimethyl-1-pyrrolyl)phenyl]-4-(methylsulfonylmethyl)benzamide IUPAC Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-4-(methylsulfonylmethyl)benzamide Traditional Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-4-(mesylmethyl)benzamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CS(=O)(=O)C)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CS(=O)(=O)C)C

InChI

InChI=1S/C21H22N2O3S/c1-15-4-5-16(2)23(15)20-12-10-19(11-13-20)22-21(24)18-8-6-17(7-9-18)14-27(3,25)26/h4-13H,14H2,1-3H3,(H,22,24)