N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-4-ethoxy-3-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-4-ethoxy-3-fluoranyl-benzenesulfonamide Openeye Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-4-ethoxy-3-fluoro-benzenesulfonamide CAS Name: N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-4-ethoxy-3-fluorobenzenesulfonamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-4-ethoxy-3-fluorobenzenesulfonamide Traditional Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-4-ethoxy-3-fluoro-benzenesulfonamide Formula: C16H21FN2O3S2 MolecularWeight: 372.477943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NCC(C2=CSC=C2)N(C)C)F

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)NCC(C2=CSC=C2)N(C)C)F

InChI

InChI=1S/C16H21FN2O3S2/c1-4-22-16-6-5-13(9-14(16)17)24(20,21)18-10-15(19(2)3)12-7-8-23-11-12/h5-9,11,15,18H,4,10H2,1-3H3