4-[2-[(2-oxidanylidene-1-propan-2-ylsulfonyl-imidazo[4,5-c]pyridin-3-yl)methyl]benzimidazol-1-yl]butanenitrile

Systemtic Name: 4-[2-[(2-oxidanylidene-1-propan-2-ylsulfonyl-imidazo[4,5-c]pyridin-3-yl)methyl]benzimidazol-1-yl]butanenitrile Openeye Name: 4-[2-[(1-isopropylsulfonyl-2-oxo-imidazo[4,5-c]pyridin-3-yl)methyl]benzimidazol-1-yl]butanenitrile CAS Name: 4-[2-[(2-oxo-1-propan-2-ylsulfonyl-3-imidazo[4,5-c]pyridinyl)methyl]-1-benzimidazolyl]butanenitrile IUPAC Name: 4-[2-[(2-oxo-1-propan-2-ylsulfonylimidazo[4,5-c]pyridin-3-yl)methyl]benzimidazol-1-yl]butanenitrile Traditional Name: 4-[2-[(1-isopropylsulfonyl-2-keto-imidazo[4,5-c]pyridin-3-yl)methyl]benzimidazol-1-yl]butyronitrile Formula: C21H22N6O3S MolecularWeight: 438.50278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=NC=C2)N(C1=O)CC3=NC4=CC=CC=C4N3CCCC#N

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=C(C=NC=C2)N(C1=O)CC3=NC4=CC=CC=C4N3CCCC#N

InChI

InChI=1S/C21H22N6O3S/c1-15(2)31(29,30)27-18-9-11-23-13-19(18)26(21(27)28)14-20-24-16-7-3-4-8-17(16)25(20)12-6-5-10-22/h3-4,7-9,11,13,15H,5-6,12,14H2,1-2H3