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

Systemtic Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]quinoline-2-carboxamide Openeye Name: N-[6-(diisobutylsulfamoyl)-1,3-benzothiazol-2-yl]quinoline-2-carboxamide CAS Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]-2-quinolinecarboxamide IUPAC Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]quinoline-2-carboxamide Traditional Name: N-[6-(diisobutylsulfamoyl)-1,3-benzothiazol-2-yl]quinaldamide Formula: C25H28N4O3S2 MolecularWeight: 496.64482

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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=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)CN(CC(C)C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H28N4O3S2/c1-16(2)14-29(15-17(3)4)34(31,32)19-10-12-21-23(13-19)33-25(27-21)28-24(30)22-11-9-18-7-5-6-8-20(18)26-22/h5-13,16-17H,14-15H2,1-4H3,(H,27,28,30)