N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-propan-2-yl-pyrrol-2-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-propan-2-yl-pyrrol-2-yl]-2-fluoranyl-benzamide Openeye Name: 2-fluoro-N-[1-isopropyl-4,5-dimethyl-3-(p-tolylsulfonyl)pyrrol-2-yl]benzamide CAS Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-propan-2-yl-2-pyrrolyl]-2-fluorobenzamide IUPAC Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-propan-2-ylpyrrol-2-yl]-2-fluorobenzamide Traditional Name: 2-fluoro-N-(1-isopropyl-4,5-dimethyl-3-tosyl-pyrrol-2-yl)benzamide Formula: C23H25FN2O3S MolecularWeight: 428.519603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C(=C2C)C)C(C)C)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C(=C2C)C)C(C)C)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C23H25FN2O3S/c1-14(2)26-17(5)16(4)21(30(28,29)18-12-10-15(3)11-13-18)22(26)25-23(27)19-8-6-7-9-20(19)24/h6-14H,1-5H3,(H,25,27)