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

Systemtic Name: 2-ethyl-4-[(4-methyl-1,3-benzothiazol-5-yl)carbonyl]-1H-pyrazol-3-one Openeye Name: 2-ethyl-4-(4-methyl-1,3-benzothiazole-5-carbonyl)-1H-pyrazol-3-one CAS Name: 2-ethyl-4-[(4-methyl-1,3-benzothiazol-5-yl)-oxomethyl]-1H-pyrazol-3-one IUPAC Name: 2-ethyl-4-(4-methyl-1,3-benzothiazole-5-carbonyl)-1H-pyrazol-3-one Traditional Name: 2-ethyl-4-(4-methyl-1,3-benzothiazole-5-carbonyl)-3-pyrazolin-3-one Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CN1)C(=O)C2=C(C3=C(C=C2)SC=N3)C

Isomeric SMILES

CCN1C(=O)C(=CN1)C(=O)C2=C(C3=C(C=C2)SC=N3)C

InChI

InChI=1S/C14H13N3O2S/c1-3-17-14(19)10(6-16-17)13(18)9-4-5-11-12(8(9)2)15-7-20-11/h4-7,16H,3H2,1-2H3