3-tert-butyl-N-[3-[[3-[(6-methoxypyridin-3-yl)amino]-1H-pyrazol-5-yl]methylsulfanyl]phenyl]-4-oxidanyl-benzamide

Systemtic Name: 3-tert-butyl-N-[3-[[3-[(6-methoxypyridin-3-yl)amino]-1H-pyrazol-5-yl]methylsulfanyl]phenyl]-4-oxidanyl-benzamide Openeye Name: 3-tert-butyl-4-hydroxy-N-[3-[[3-[(6-methoxy-3-pyridyl)amino]-1H-pyrazol-5-yl]methylsulfanyl]phenyl]benzamide CAS Name: 3-tert-butyl-4-hydroxy-N-[3-[[3-[(6-methoxy-3-pyridinyl)amino]-1H-pyrazol-5-yl]methylthio]phenyl]benzamide IUPAC Name: 3-tert-butyl-4-hydroxy-N-[3-[[3-[(6-methoxypyridin-3-yl)amino]-1H-pyrazol-5-yl]methylsulfanyl]phenyl]benzamide Traditional Name: 3-tert-butyl-4-hydroxy-N-[3-[[3-[(6-methoxy-3-pyridyl)amino]-1H-pyrazol-5-yl]methylthio]phenyl]benzamide Formula: C27H29N5O3S MolecularWeight: 503.61586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C(=O)NC2=CC(=CC=C2)SCC3=CC(=NN3)NC4=CN=C(C=C4)OC)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C(=O)NC2=CC(=CC=C2)SCC3=CC(=NN3)NC4=CN=C(C=C4)OC)O

InChI

InChI=1S/C27H29N5O3S/c1-27(2,3)22-12-17(8-10-23(22)33)26(34)30-18-6-5-7-21(13-18)36-16-20-14-24(32-31-20)29-19-9-11-25(35-4)28-15-19/h5-15,33H,16H2,1-4H3,(H,30,34)(H2,29,31,32)