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

Systemtic Name: 4-fluoranyl-N-[1-(3-methoxypropyl)-4,5-dimethyl-3-(phenylsulfonyl)pyrrol-2-yl]benzamide Openeye Name: N-[3-(benzenesulfonyl)-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-4-fluoro-benzamide CAS Name: N-[3-(benzenesulfonyl)-1-(3-methoxypropyl)-4,5-dimethyl-2-pyrrolyl]-4-fluorobenzamide IUPAC Name: N-[3-(benzenesulfonyl)-1-(3-methoxypropyl)-4,5-dimethylpyrrol-2-yl]-4-fluorobenzamide Traditional Name: N-[3-besyl-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-4-fluoro-benzamide Formula: C23H25FN2O4S MolecularWeight: 444.519003

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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=C(C=C3)F)CCCOC)C

Isomeric SMILES

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

InChI

InChI=1S/C23H25FN2O4S/c1-16-17(2)26(14-7-15-30-3)22(25-23(27)18-10-12-19(24)13-11-18)21(16)31(28,29)20-8-5-4-6-9-20/h4-6,8-13H,7,14-15H2,1-3H3,(H,25,27)