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

Systemtic Name: N-(2-diethylaminoethyl)-N-(6-fluoranyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(2-diethylaminoethyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(2-diethylaminoethyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(2-diethylaminoethyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-(2-diethylaminoethyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-(p-tolylthio)propionamide Formula: C23H28FN3OS2 MolecularWeight: 445.616323

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C23H28FN3OS2/c1-4-26(5-2)13-14-27(23-25-20-11-8-18(24)16-21(20)30-23)22(28)12-15-29-19-9-6-17(3)7-10-19/h6-11,16H,4-5,12-15H2,1-3H3