N-(1-methylpyrazol-3-yl)-4-phenylsulfanyl-butanamide

Systemtic Name: N-(1-methylpyrazol-3-yl)-4-phenylsulfanyl-butanamide Openeye Name: N-(1-methylpyrazol-3-yl)-4-phenylsulfanyl-butanamide CAS Name: N-(1-methyl-3-pyrazolyl)-4-(phenylthio)butanamide IUPAC Name: N-(1-methylpyrazol-3-yl)-4-phenylsulfanylbutanamide Traditional Name: N-(1-methylpyrazol-3-yl)-4-(phenylthio)butyramide Formula: C14H17N3OS MolecularWeight: 275.36928

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)CCCSC2=CC=CC=C2

Isomeric SMILES

CN1C=CC(=N1)NC(=O)CCCSC2=CC=CC=C2

InChI

InChI=1S/C14H17N3OS/c1-17-10-9-13(16-17)15-14(18)8-5-11-19-12-6-3-2-4-7-12/h2-4,6-7,9-10H,5,8,11H2,1H3,(H,15,16,18)