N-[(1-phenylpyrazol-4-yl)methyl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[(1-phenylpyrazol-4-yl)methyl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[(1-phenylpyrazol-4-yl)methyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[(1-phenyl-4-pyrazolyl)methyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[(1-phenylpyrazol-4-yl)methyl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[(1-phenylpyrazol-4-yl)methyl]-2-(phenylthio)nicotinamide Formula: C22H18N4OS MolecularWeight: 386.46952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C22H18N4OS/c27-21(20-12-7-13-23-22(20)28-19-10-5-2-6-11-19)24-14-17-15-25-26(16-17)18-8-3-1-4-9-18/h1-13,15-16H,14H2,(H,24,27)