4-[[2-(4-fluorophenyl)-4-methyl-1,3-benzothiazol-5-yl]carbonyl]-2-propan-2-yl-1H-pyrazol-3-one

Systemtic Name: 4-[[2-(4-fluorophenyl)-4-methyl-1,3-benzothiazol-5-yl]carbonyl]-2-propan-2-yl-1H-pyrazol-3-one Openeye Name: 4-[2-(4-fluorophenyl)-4-methyl-1,3-benzothiazole-5-carbonyl]-2-isopropyl-1H-pyrazol-3-one CAS Name: 4-[[2-(4-fluorophenyl)-4-methyl-1,3-benzothiazol-5-yl]-oxomethyl]-2-propan-2-yl-1H-pyrazol-3-one IUPAC Name: 4-[2-(4-fluorophenyl)-4-methyl-1,3-benzothiazole-5-carbonyl]-2-propan-2-yl-1H-pyrazol-3-one Traditional Name: 4-[2-(4-fluorophenyl)-4-methyl-1,3-benzothiazole-5-carbonyl]-2-isopropyl-3-pyrazolin-3-one Formula: C21H18FN3O2S MolecularWeight: 395.449923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)C3=CC=C(C=C3)F)C(=O)C4=CNN(C4=O)C(C)C

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)C3=CC=C(C=C3)F)C(=O)C4=CNN(C4=O)C(C)C

InChI

InChI=1S/C21H18FN3O2S/c1-11(2)25-21(27)16(10-23-25)19(26)15-8-9-17-18(12(15)3)24-20(28-17)13-4-6-14(22)7-5-13/h4-11,23H,1-3H3