N-[2-(phenylmethyl)pyrazol-3-yl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[2-(phenylmethyl)pyrazol-3-yl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-(2-benzylpyrazol-3-yl)-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[2-(phenylmethyl)-3-pyrazolyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-(2-benzylpyrazol-3-yl)-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-(2-benzylpyrazol-3-yl)-2-(phenylthio)nicotinamide Formula: C22H18N4OS MolecularWeight: 386.46952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

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