6-cyano-N-[3-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]pyridine-3-carboxamide

Systemtic Name: 6-cyano-N-[3-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]pyridine-3-carboxamide Openeye Name: 6-cyano-N-[3-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]pyridine-3-carboxamide CAS Name: 6-cyano-N-[3-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]-3-pyridinecarboxamide IUPAC Name: 6-cyano-N-[3-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]pyridine-3-carboxamide Traditional Name: 6-cyano-N-[3-[4-(5-esyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]nicotinamide Formula: C25H18N6O4S MolecularWeight: 498.51322

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3=C(NN=C3)C4=CC(=CC=C4)NC(=O)C5=CN=C(C=C5)C#N

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3=C(NN=C3)C4=CC(=CC=C4)NC(=O)C5=CN=C(C=C5)C#N

InChI

InChI=1S/C25H18N6O4S/c1-2-36(33,34)19-8-9-22-21(11-19)30-25(35-22)20-14-28-31-23(20)15-4-3-5-17(10-15)29-24(32)16-6-7-18(12-26)27-13-16/h3-11,13-14H,2H2,1H3,(H,28,31)(H,29,32)