5-methyl-2-phenyl-4-propan-2-yl-1-thiophen-2-ylcarbonyl-pyrazol-3-one

Systemtic Name: 5-methyl-2-phenyl-4-propan-2-yl-1-thiophen-2-ylcarbonyl-pyrazol-3-one Openeye Name: 4-isopropyl-5-methyl-2-phenyl-1-(thiophene-2-carbonyl)pyrazol-3-one CAS Name: 5-methyl-1-[oxo(thiophen-2-yl)methyl]-2-phenyl-4-propan-2-yl-3-pyrazolone IUPAC Name: 5-methyl-2-phenyl-4-propan-2-yl-1-(thiophene-2-carbonyl)pyrazol-3-one Traditional Name: 4-isopropyl-5-methyl-2-phenyl-1-(2-thenoyl)-3-pyrazolin-3-one Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C(=O)C2=CC=CS2)C3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C(=O)C2=CC=CS2)C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C18H18N2O2S/c1-12(2)16-13(3)19(17(21)15-10-7-11-23-15)20(18(16)22)14-8-5-4-6-9-14/h4-12H,1-3H3