3-[[(1-ethyl-2-methyl-benzimidazol-5-yl)carbonylamino]carbamoyl]-N-prop-2-ynyl-benzenesulfonamide

Systemtic Name: 3-[[(1-ethyl-2-methyl-benzimidazol-5-yl)carbonylamino]carbamoyl]-N-prop-2-ynyl-benzenesulfonamide Openeye Name: 3-[[(1-ethyl-2-methyl-benzimidazole-5-carbonyl)amino]carbamoyl]-N-prop-2-ynyl-benzenesulfonamide CAS Name: 3-[[[(1-ethyl-2-methyl-5-benzimidazolyl)-oxomethyl]hydrazo]-oxomethyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 3-[[(1-ethyl-2-methylbenzimidazole-5-carbonyl)amino]carbamoyl]-N-prop-2-ynylbenzenesulfonamide Traditional Name: 3-[[(1-ethyl-2-methyl-benzimidazole-5-carbonyl)amino]carbamoyl]-N-propargyl-benzenesulfonamide Formula: C21H21N5O4S MolecularWeight: 439.48754

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C=CC(=C2)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC#C)C

Isomeric SMILES

CCN1C(=NC2=C1C=CC(=C2)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC#C)C

InChI

InChI=1S/C21H21N5O4S/c1-4-11-22-31(29,30)17-8-6-7-15(12-17)20(27)24-25-21(28)16-9-10-19-18(13-16)23-14(3)26(19)5-2/h1,6-10,12-13,22H,5,11H2,2-3H3,(H,24,27)(H,25,28)