2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-(2-oxidanylidene-5-pyrrolidin-1-ylsulfonyl-pyridin-1-yl)butanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-(2-oxidanylidene-5-pyrrolidin-1-ylsulfonyl-pyridin-1-yl)butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(2-oxo-5-pyrrolidin-1-ylsulfonyl-1-pyridyl)butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[2-oxo-5-(1-pyrrolidinylsulfonyl)-1-pyridinyl]butanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(2-oxo-5-pyrrolidin-1-ylsulfonylpyridin-1-yl)butanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-4-(2-keto-5-pyrrolidinosulfonyl-1-pyridyl)butyronitrile Formula: C20H19N5O4S MolecularWeight: 425.46096

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN(C(=O)C=C2)CC(=O)C(=C3NC4=CC=CC=C4N3)C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN(C(=O)C=C2)CC(=O)C(=C3NC4=CC=CC=C4N3)C#N

InChI

InChI=1S/C20H19N5O4S/c21-11-15(20-22-16-5-1-2-6-17(16)23-20)18(26)13-24-12-14(7-8-19(24)27)30(28,29)25-9-3-4-10-25/h1-2,5-8,12,22-23H,3-4,9-10,13H2