1-[2-(5-methyl-1-phenyl-pyrazol-4-yl)carbonylpyrazolidin-1-yl]-3-methylsulfanyl-propan-1-one

Systemtic Name: 1-[2-(5-methyl-1-phenyl-pyrazol-4-yl)carbonylpyrazolidin-1-yl]-3-methylsulfanyl-propan-1-one Openeye Name: 1-[2-(5-methyl-1-phenyl-pyrazole-4-carbonyl)pyrazolidin-1-yl]-3-methylsulfanyl-propan-1-one CAS Name: 1-[2-[(5-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]-1-pyrazolidinyl]-3-(methylthio)-1-propanone IUPAC Name: 1-[2-(5-methyl-1-phenylpyrazole-4-carbonyl)pyrazolidin-1-yl]-3-methylsulfanylpropan-1-one Traditional Name: 1-[2-(5-methyl-1-phenyl-pyrazole-4-carbonyl)pyrazolidin-1-yl]-3-(methylthio)propan-1-one Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCCN3C(=O)CCSC

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCCN3C(=O)CCSC

InChI

InChI=1S/C18H22N4O2S/c1-14-16(13-19-22(14)15-7-4-3-5-8-15)18(24)21-11-6-10-20(21)17(23)9-12-25-2/h3-5,7-8,13H,6,9-12H2,1-2H3