1-(diethylsulfamoyl)-N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]piperidine-4-carboxamide

Systemtic Name: 1-(diethylsulfamoyl)-N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]piperidine-4-carboxamide Openeye Name: 1-(diethylsulfamoyl)-N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]piperidine-4-carboxamide CAS Name: 1-(diethylsulfamoyl)-N-[2-[(2-methyl-1-oxopropyl)amino]-1,3-benzothiazol-5-yl]-4-piperidinecarboxamide IUPAC Name: 1-(diethylsulfamoyl)-N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]piperidine-4-carboxamide Traditional Name: 1-(diethylsulfamoyl)-N-[2-(isobutyrylamino)-1,3-benzothiazol-5-yl]isonipecotamide Formula: C21H31N5O4S2 MolecularWeight: 481.63194

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)SC(=N3)NC(=O)C(C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)SC(=N3)NC(=O)C(C)C

InChI

InChI=1S/C21H31N5O4S2/c1-5-25(6-2)32(29,30)26-11-9-15(10-12-26)20(28)22-16-7-8-18-17(13-16)23-21(31-18)24-19(27)14(3)4/h7-8,13-15H,5-6,9-12H2,1-4H3,(H,22,28)(H,23,24,27)