N-(2-diethylaminoethyl)-2-(4-fluorophenyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: N-(2-diethylaminoethyl)-2-(4-fluorophenyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: N-(2-diethylaminoethyl)-2-(4-fluorophenyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(2-diethylaminoethyl)-2-(4-fluorophenyl)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]acetamide IUPAC Name: N-(2-diethylaminoethyl)-2-(4-fluorophenyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: N-(2-diethylaminoethyl)-2-(4-fluorophenyl)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]acetamide Formula: C22H26FN3OS2 MolecularWeight: 431.589743

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)CC3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3OS2/c1-4-25(5-2)12-13-26(21(27)14-16-6-8-17(23)9-7-16)22-24-19-11-10-18(28-3)15-20(19)29-22/h6-11,15H,4-5,12-14H2,1-3H3