N-(2-diethylaminoethyl)-N-(6-fluoranyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-propanamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(6-fluoranyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-propanamide Openeye Name: N-(2-diethylaminoethyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-propanamide CAS Name: N-(2-diethylaminoethyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)thio]propanamide IUPAC Name: N-(2-diethylaminoethyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanylpropanamide Traditional Name: N-(2-diethylaminoethyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)thio]propionamide Formula: C22H25F2N3OS2 MolecularWeight: 449.580206

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)F)C(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)F)C(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C22H25F2N3OS2/c1-3-26(4-2)12-13-27(22-25-19-10-7-17(24)15-20(19)30-22)21(28)11-14-29-18-8-5-16(23)6-9-18/h5-10,15H,3-4,11-14H2,1-2H3