4-tert-butyl-N-(3-methylsulfanyl-4-pyridin-2-yl-1H-pyrazol-5-yl)benzamide

Systemtic Name: 4-tert-butyl-N-(3-methylsulfanyl-4-pyridin-2-yl-1H-pyrazol-5-yl)benzamide Openeye Name: 4-tert-butyl-N-[3-methylsulfanyl-4-(2-pyridyl)-1H-pyrazol-5-yl]benzamide CAS Name: 4-tert-butyl-N-[3-(methylthio)-4-(2-pyridinyl)-1H-pyrazol-5-yl]benzamide IUPAC Name: 4-tert-butyl-N-(3-methylsulfanyl-4-pyridin-2-yl-1H-pyrazol-5-yl)benzamide Traditional Name: 4-tert-butyl-N-[3-(methylthio)-4-(2-pyridyl)-1H-pyrazol-5-yl]benzamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C(=NN2)SC)C3=CC=CC=N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C(=NN2)SC)C3=CC=CC=N3

InChI

InChI=1S/C20H22N4OS/c1-20(2,3)14-10-8-13(9-11-14)18(25)22-17-16(19(26-4)24-23-17)15-7-5-6-12-21-15/h5-12H,1-4H3,(H2,22,23,24,25)