4-(4-chlorophenyl)sulfanyl-N-(2-dimethylaminoethyl)-N-(4-fluoranyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-N-(2-dimethylaminoethyl)-N-(4-fluoranyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-(4-chlorophenyl)sulfanyl-N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-[(4-chlorophenyl)thio]-N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-(4-chlorophenyl)sulfanyl-N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-[(4-chlorophenyl)thio]-N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)butyramide Formula: C21H23ClFN3OS2 MolecularWeight: 452.008223

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(C=CC=C2S1)F)C(=O)CCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C)CCN(C1=NC2=C(C=CC=C2S1)F)C(=O)CCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClFN3OS2/c1-25(2)12-13-26(21-24-20-17(23)5-3-6-18(20)29-21)19(27)7-4-14-28-16-10-8-15(22)9-11-16/h3,5-6,8-11H,4,7,12-14H2,1-2H3