N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-phenylsulfanyl-butanamide

Systemtic Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-phenylsulfanyl-butanamide Openeye Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-phenylsulfanyl-butanamide CAS Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-(phenylthio)butanamide IUPAC Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-phenylsulfanylbutanamide Traditional Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-(phenylthio)butyramide Formula: C15H19N3OS MolecularWeight: 289.39586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)NC(=O)CCCSC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NN1)C)NC(=O)CCCSC2=CC=CC=C2

InChI

InChI=1S/C15H19N3OS/c1-11-15(12(2)18-17-11)16-14(19)9-6-10-20-13-7-4-3-5-8-13/h3-5,7-8H,6,9-10H2,1-2H3,(H,16,19)(H,17,18)