5-azanyl-2-(2-naphthalen-1-yl-2-sulfanyl-ethyl)-1H-pyrazol-3-one

Systemtic Name: 5-azanyl-2-(2-naphthalen-1-yl-2-sulfanyl-ethyl)-1H-pyrazol-3-one Openeye Name: 5-amino-2-[2-(1-naphthyl)-2-sulfanyl-ethyl]-1H-pyrazol-3-one CAS Name: 5-amino-2-[2-mercapto-2-(1-naphthalenyl)ethyl]-1H-pyrazol-3-one IUPAC Name: 5-amino-2-(2-naphthalen-1-yl-2-sulfanylethyl)-1H-pyrazol-3-one Traditional Name: 5-amino-2-[2-mercapto-2-(1-naphthyl)ethyl]-3-pyrazolin-3-one Formula: C15H15N3OS MolecularWeight: 285.3641

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(CN3C(=O)C=C(N3)N)S

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(CN3C(=O)C=C(N3)N)S

InChI

InChI=1S/C15H15N3OS/c16-14-8-15(19)18(17-14)9-13(20)12-7-3-5-10-4-1-2-6-11(10)12/h1-8,13,17,20H,9,16H2