N-(2-dimethylaminoethyl)-N-(4-fluoranyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-(4-fluoranyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-3-[(4-methoxyphenyl)thio]propionamide Formula: C21H24FN3O2S2 MolecularWeight: 433.562563

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(C=CC=C2S1)F)C(=O)CCSC3=CC=C(C=C3)OC

Isomeric SMILES

CN(C)CCN(C1=NC2=C(C=CC=C2S1)F)C(=O)CCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24FN3O2S2/c1-24(2)12-13-25(21-23-20-17(22)5-4-6-18(20)29-21)19(26)11-14-28-16-9-7-15(27-3)8-10-16/h4-10H,11-14H2,1-3H3