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

Systemtic Name: 4-[[2-(4-methoxyphenyl)-4-methyl-1,3-benzothiazol-5-yl]carbonyl]-2-methyl-1H-pyrazol-3-one Openeye Name: 4-[2-(4-methoxyphenyl)-4-methyl-1,3-benzothiazole-5-carbonyl]-2-methyl-1H-pyrazol-3-one CAS Name: 4-[[2-(4-methoxyphenyl)-4-methyl-1,3-benzothiazol-5-yl]-oxomethyl]-2-methyl-1H-pyrazol-3-one IUPAC Name: 4-[2-(4-methoxyphenyl)-4-methyl-1,3-benzothiazole-5-carbonyl]-2-methyl-1H-pyrazol-3-one Traditional Name: 4-[2-(4-methoxyphenyl)-4-methyl-1,3-benzothiazole-5-carbonyl]-2-methyl-3-pyrazolin-3-one Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O3S/c1-11-14(18(24)15-10-21-23(2)20(15)25)8-9-16-17(11)22-19(27-16)12-4-6-13(26-3)7-5-12/h4-10,21H,1-3H3