N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]pyridine-3-carboxamide Openeye Name: N-[6-(diisobutylsulfamoyl)-1,3-benzothiazol-2-yl]pyridine-3-carboxamide CAS Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]pyridine-3-carboxamide Traditional Name: N-[6-(diisobutylsulfamoyl)-1,3-benzothiazol-2-yl]nicotinamide Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN=CC=C3

Isomeric SMILES

CC(C)CN(CC(C)C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H26N4O3S2/c1-14(2)12-25(13-15(3)4)30(27,28)17-7-8-18-19(10-17)29-21(23-18)24-20(26)16-6-5-9-22-11-16/h5-11,14-15H,12-13H2,1-4H3,(H,23,24,26)