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

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-(4-fluorophenyl)sulfanyl-propanamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-(4-fluorophenyl)sulfanyl-propanamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-[(4-fluorophenyl)thio]propanamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-(4-fluorophenyl)sulfanylpropanamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-[(4-fluorophenyl)thio]propionamide Formula: C22H25ClFN3OS2 MolecularWeight: 466.034803

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2Cl)C(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2Cl)C(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C22H25ClFN3OS2/c1-3-26(4-2)13-14-27(22-25-21-18(23)6-5-7-19(21)30-22)20(28)12-15-29-17-10-8-16(24)9-11-17/h5-11H,3-4,12-15H2,1-2H3