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

Systemtic Name: 4-[(2-chloranyl-4-methyl-1,3-benzothiazol-5-yl)carbonyl]-2-methyl-1H-pyrazol-3-one Openeye Name: 4-(2-chloro-4-methyl-1,3-benzothiazole-5-carbonyl)-2-methyl-1H-pyrazol-3-one CAS Name: 4-[(2-chloro-4-methyl-1,3-benzothiazol-5-yl)-oxomethyl]-2-methyl-1H-pyrazol-3-one IUPAC Name: 4-(2-chloro-4-methyl-1,3-benzothiazole-5-carbonyl)-2-methyl-1H-pyrazol-3-one Traditional Name: 4-(2-chloro-4-methyl-1,3-benzothiazole-5-carbonyl)-2-methyl-3-pyrazolin-3-one Formula: C13H10ClN3O2S MolecularWeight: 307.7554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10ClN3O2S/c1-6-7(3-4-9-10(6)16-13(14)20-9)11(18)8-5-15-17(2)12(8)19/h3-5,15H,1-2H3