N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-(4-fluorophenyl)sulfonyl-ethanamide

Systemtic Name: N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-(4-fluorophenyl)sulfonyl-ethanamide Openeye Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-(4-fluorophenyl)sulfonyl-acetamide CAS Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-(4-fluorophenyl)sulfonylacetamide IUPAC Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-(4-fluorophenyl)sulfonylacetamide Traditional Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-(4-fluorophenyl)sulfonyl-acetamide Formula: C22H25ClFN3O3S2 MolecularWeight: 498.033603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25ClFN3O3S2/c1-4-26(5-2)12-13-27(22-25-20-15(3)6-11-18(23)21(20)31-22)19(28)14-32(29,30)17-9-7-16(24)8-10-17/h6-11H,4-5,12-14H2,1-3H3