1,2-benzoxazol-3-ylmethanesulfonamide; 2-(2-oxidanylidene-1-phenyl-5-pyridin-2-yl-pyridin-3-yl)benzenecarbonitrile

Systemtic Name: 1,2-benzoxazol-3-ylmethanesulfonamide; 2-(2-oxidanylidene-1-phenyl-5-pyridin-2-yl-pyridin-3-yl)benzenecarbonitrile Openeye Name: 1,2-benzoxazol-3-ylmethanesulfonamide; 2-[2-oxo-1-phenyl-5-(2-pyridyl)-3-pyridyl]benzonitrile CAS Name: 1,2-benzoxazol-3-ylmethanesulfonamide; 2-[2-oxo-1-phenyl-5-(2-pyridinyl)-3-pyridinyl]benzonitrile IUPAC Name: 1,2-benzoxazol-3-ylmethanesulfonamide; 2-(2-oxo-1-phenyl-5-pyridin-2-ylpyridin-3-yl)benzonitrile Traditional Name: indoxazen-3-ylmethanesulfonamide; 2-[2-keto-1-phenyl-5-(2-pyridyl)-3-pyridyl]benzonitrile Formula: C31H23N5O4S MolecularWeight: 561.61042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=C(C2=O)C3=CC=CC=C3C#N)C4=CC=CC=N4.C1=CC=C2C(=C1)C(=NO2)CS(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=C(C2=O)C3=CC=CC=C3C#N)C4=CC=CC=N4.C1=CC=C2C(=C1)C(=NO2)CS(=O)(=O)N

InChI

InChI=1S/C23H15N3O.C8H8N2O3S/c24-15-17-8-4-5-11-20(17)21-14-18(22-12-6-7-13-25-22)16-26(23(21)27)19-9-2-1-3-10-19;9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-14,16H;1-4H,5H2,(H2,9,11,12)