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

Systemtic Name: N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-fluorophenyl)sulfonyl-propanamide Openeye Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-fluorophenyl)sulfonyl-propanamide CAS Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-fluorophenyl)sulfonylpropanamide IUPAC Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-fluorophenyl)sulfonylpropanamide Traditional Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-fluorophenyl)sulfonyl-propionamide Formula: C21H23ClFN3O3S2 MolecularWeight: 484.007023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CCN(C)C)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CCN(C)C)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23ClFN3O3S2/c1-14-4-9-17(22)20-19(14)24-21(30-20)26(12-11-25(2)3)18(27)10-13-31(28,29)16-7-5-15(23)6-8-16/h4-9H,10-13H2,1-3H3