N,N-diethyl-3-[[2-(1-methylbenzimidazol-2-yl)ethanoylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[[2-(1-methylbenzimidazol-2-yl)ethanoylamino]carbamoyl]benzenesulfonamide Openeye Name: N,N-diethyl-3-[[[2-(1-methylbenzimidazol-2-yl)acetyl]amino]carbamoyl]benzenesulfonamide CAS Name: N,N-diethyl-3-[[[2-(1-methyl-2-benzimidazolyl)-1-oxoethyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[[[2-(1-methylbenzimidazol-2-yl)acetyl]amino]carbamoyl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[[[2-(1-methylbenzimidazol-2-yl)acetyl]amino]carbamoyl]benzenesulfonamide Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C21H25N5O4S/c1-4-26(5-2)31(29,30)16-10-8-9-15(13-16)21(28)24-23-20(27)14-19-22-17-11-6-7-12-18(17)25(19)3/h6-13H,4-5,14H2,1-3H3,(H,23,27)(H,24,28)