3-fluoranyl-N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(phenylsulfonyl)pyrrol-2-yl]benzamide

Systemtic Name: 3-fluoranyl-N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(phenylsulfonyl)pyrrol-2-yl]benzamide Openeye Name: N-[3-(benzenesulfonyl)-1-(2-methoxyethyl)-4,5-dimethyl-pyrrol-2-yl]-3-fluoro-benzamide CAS Name: N-[3-(benzenesulfonyl)-1-(2-methoxyethyl)-4,5-dimethyl-2-pyrrolyl]-3-fluorobenzamide IUPAC Name: N-[3-(benzenesulfonyl)-1-(2-methoxyethyl)-4,5-dimethylpyrrol-2-yl]-3-fluorobenzamide Traditional Name: N-[3-besyl-1-(2-methoxyethyl)-4,5-dimethyl-pyrrol-2-yl]-3-fluoro-benzamide Formula: C22H23FN2O4S MolecularWeight: 430.492423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)F)CCOC)C

Isomeric SMILES

CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)F)CCOC)C

InChI

InChI=1S/C22H23FN2O4S/c1-15-16(2)25(12-13-29-3)21(24-22(26)17-8-7-9-18(23)14-17)20(15)30(27,28)19-10-5-4-6-11-19/h4-11,14H,12-13H2,1-3H3,(H,24,26)