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

Systemtic Name: 4-[[2-(methoxymethyl)-4-methyl-1,3-benzothiazol-5-yl]carbonyl]-2-propan-2-yl-1H-pyrazol-3-one Openeye Name: 2-isopropyl-4-[2-(methoxymethyl)-4-methyl-1,3-benzothiazole-5-carbonyl]-1H-pyrazol-3-one CAS Name: 4-[[2-(methoxymethyl)-4-methyl-1,3-benzothiazol-5-yl]-oxomethyl]-2-propan-2-yl-1H-pyrazol-3-one IUPAC Name: 4-[2-(methoxymethyl)-4-methyl-1,3-benzothiazole-5-carbonyl]-2-propan-2-yl-1H-pyrazol-3-one Traditional Name: 2-isopropyl-4-[2-(methoxymethyl)-4-methyl-1,3-benzothiazole-5-carbonyl]-3-pyrazolin-3-one Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)COC)C(=O)C3=CNN(C3=O)C(C)C

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)COC)C(=O)C3=CNN(C3=O)C(C)C

InChI

InChI=1S/C17H19N3O3S/c1-9(2)20-17(22)12(7-18-20)16(21)11-5-6-13-15(10(11)3)19-14(24-13)8-23-4/h5-7,9,18H,8H2,1-4H3