N-(2-dimethylaminoethyl)-2-(4-fluorophenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: N-(2-dimethylaminoethyl)-2-(4-fluorophenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: N-(2-dimethylaminoethyl)-2-(4-fluorophenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(2-dimethylaminoethyl)-2-[(4-fluorophenyl)thio]-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: N-(2-dimethylaminoethyl)-2-(4-fluorophenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: N-(2-dimethylaminoethyl)-2-[(4-fluorophenyl)thio]-N-(4-mesyl-1,3-benzothiazol-2-yl)acetamide Formula: C20H22FN3O3S3 MolecularWeight: 467.600383

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)CSC3=CC=C(C=C3)F

Isomeric SMILES

CN(C)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)CSC3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O3S3/c1-23(2)11-12-24(18(25)13-28-15-9-7-14(21)8-10-15)20-22-19-16(29-20)5-4-6-17(19)30(3,26)27/h4-10H,11-13H2,1-3H3