(4S)-2-(4-chlorophenyl)-5-propan-2-yl-4-thiophen-2-ylcarbonyl-4H-pyrazol-3-one

Systemtic Name: (4S)-2-(4-chlorophenyl)-5-propan-2-yl-4-thiophen-2-ylcarbonyl-4H-pyrazol-3-one Openeye Name: (4S)-2-(4-chlorophenyl)-5-isopropyl-4-(thiophene-2-carbonyl)-4H-pyrazol-3-one CAS Name: (4S)-2-(4-chlorophenyl)-4-[oxo(thiophen-2-yl)methyl]-5-propan-2-yl-4H-pyrazol-3-one IUPAC Name: (4S)-2-(4-chlorophenyl)-5-propan-2-yl-4-(thiophene-2-carbonyl)-4H-pyrazol-3-one Traditional Name: (4S)-2-(4-chlorophenyl)-5-isopropyl-4-(2-thenoyl)-2-pyrazolin-3-one Formula: C17H15ClN2O2S MolecularWeight: 346.8312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=O)C1C(=O)C2=CC=CS2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C1=NN(C(=O)[C@@H]1C(=O)C2=CC=CS2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H15ClN2O2S/c1-10(2)15-14(16(21)13-4-3-9-23-13)17(22)20(19-15)12-7-5-11(18)6-8-12/h3-10,14H,1-2H3/t14-/m0/s1