4-fluoranyl-3-(methoxymethyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 4-fluoranyl-3-(methoxymethyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-3-(methoxymethyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzothiophene-2-carboxamide CAS Name: 4-fluoro-3-(methoxymethyl)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-3-(methoxymethyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-3-(methoxymethyl)-N-(4-pyrrolidinosulfonylphenyl)benzothiophene-2-carboxamide Formula: C21H21FN2O4S2 MolecularWeight: 448.530843

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(SC2=CC=CC(=C21)F)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COCC1=C(SC2=CC=CC(=C21)F)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H21FN2O4S2/c1-28-13-16-19-17(22)5-4-6-18(19)29-20(16)21(25)23-14-7-9-15(10-8-14)30(26,27)24-11-2-3-12-24/h4-10H,2-3,11-13H2,1H3,(H,23,25)