3-(1,3-benzothiazol-2-yl)-N-[4-chloranyl-3-(diethylsulfamoyl)phenyl]propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[4-chloranyl-3-(diethylsulfamoyl)phenyl]propanamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]propanamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]propanamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]propanamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]propionamide Formula: C20H22ClN3O3S2 MolecularWeight: 451.98998

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)CCC2=NC3=CC=CC=C3S2)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)CCC2=NC3=CC=CC=C3S2)Cl

InChI

InChI=1S/C20H22ClN3O3S2/c1-3-24(4-2)29(26,27)18-13-14(9-10-15(18)21)22-19(25)11-12-20-23-16-7-5-6-8-17(16)28-20/h5-10,13H,3-4,11-12H2,1-2H3,(H,22,25)