2-[2-[(1-methylpyrazol-4-yl)methylamino]phenyl]sulfanylethanamide

Systemtic Name: 2-[2-[(1-methylpyrazol-4-yl)methylamino]phenyl]sulfanylethanamide Openeye Name: 2-[2-[(1-methylpyrazol-4-yl)methylamino]phenyl]sulfanylacetamide CAS Name: 2-[[2-[(1-methyl-4-pyrazolyl)methylamino]phenyl]thio]acetamide IUPAC Name: 2-[2-[(1-methylpyrazol-4-yl)methylamino]phenyl]sulfanylacetamide Traditional Name: 2-[[2-[(1-methylpyrazol-4-yl)methylamino]phenyl]thio]acetamide Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC2=CC=CC=C2SCC(=O)N

Isomeric SMILES

CN1C=C(C=N1)CNC2=CC=CC=C2SCC(=O)N

InChI

InChI=1S/C13H16N4OS/c1-17-8-10(7-16-17)6-15-11-4-2-3-5-12(11)19-9-13(14)18/h2-5,7-8,15H,6,9H2,1H3,(H2,14,18)