2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(6-pyrazol-1-ylpyridin-3-yl)benzamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(6-pyrazol-1-ylpyridin-3-yl)benzamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(6-pyrazol-1-yl-3-pyridyl)benzamide CAS Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-[6-(1-pyrazolyl)-3-pyridinyl]benzamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(6-pyrazol-1-ylpyridin-3-yl)benzamide Traditional Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-(6-pyrazol-1-yl-3-pyridyl)benzamide Formula: C23H17N5O2S MolecularWeight: 427.47838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3O2)C(=O)NC4=CN=C(C=C4)N5C=CC=N5

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3O2)C(=O)NC4=CN=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C23H17N5O2S/c29-22(26-17-10-11-21(24-14-17)28-13-5-12-25-28)18-7-2-1-6-16(18)15-31-23-27-19-8-3-4-9-20(19)30-23/h1-14H,15H2,(H,26,29)