N-tert-butyl-4-[[2-(1-methylbenzimidazol-2-yl)ethanoylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[[2-(1-methylbenzimidazol-2-yl)ethanoylamino]carbamoyl]benzenesulfonamide Openeye Name: N-tert-butyl-4-[[[2-(1-methylbenzimidazol-2-yl)acetyl]amino]carbamoyl]benzenesulfonamide CAS Name: N-tert-butyl-4-[[[2-(1-methyl-2-benzimidazolyl)-1-oxoethyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N-tert-butyl-4-[[[2-(1-methylbenzimidazol-2-yl)acetyl]amino]carbamoyl]benzenesulfonamide Traditional Name: N-tert-butyl-4-[[[2-(1-methylbenzimidazol-2-yl)acetyl]amino]carbamoyl]benzenesulfonamide Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)CC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)CC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C21H25N5O4S/c1-21(2,3)25-31(29,30)15-11-9-14(10-12-15)20(28)24-23-19(27)13-18-22-16-7-5-6-8-17(16)26(18)4/h5-12,25H,13H2,1-4H3,(H,23,27)(H,24,28)