N-(1-methylpyrazol-3-yl)-2-phenylsulfanyl-ethanamide

Systemtic Name: N-(1-methylpyrazol-3-yl)-2-phenylsulfanyl-ethanamide Openeye Name: N-(1-methylpyrazol-3-yl)-2-phenylsulfanyl-acetamide CAS Name: N-(1-methyl-3-pyrazolyl)-2-(phenylthio)acetamide IUPAC Name: N-(1-methylpyrazol-3-yl)-2-phenylsulfanylacetamide Traditional Name: N-(1-methylpyrazol-3-yl)-2-(phenylthio)acetamide Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)CSC2=CC=CC=C2

Isomeric SMILES

CN1C=CC(=N1)NC(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C12H13N3OS/c1-15-8-7-11(14-15)13-12(16)9-17-10-5-3-2-4-6-10/h2-8H,9H2,1H3,(H,13,14,16)