4-(4-chloranyl-2,5-dimethyl-phenyl)sulfanyl-1,4-dihydropyrazol-5-one

Systemtic Name: 4-(4-chloranyl-2,5-dimethyl-phenyl)sulfanyl-1,4-dihydropyrazol-5-one Openeye Name: 4-(4-chloro-2,5-dimethyl-phenyl)sulfanyl-1,4-dihydropyrazol-5-one CAS Name: 4-[(4-chloro-2,5-dimethylphenyl)thio]-1,4-dihydropyrazol-5-one IUPAC Name: 4-(4-chloro-2,5-dimethylphenyl)sulfanyl-1,4-dihydropyrazol-5-one Traditional Name: 4-[(4-chloro-2,5-dimethyl-phenyl)thio]-2-pyrazolin-3-one Formula: C11H11ClN2OS MolecularWeight: 254.73584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)SC2C=NNC2=O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)SC2C=NNC2=O

InChI

InChI=1S/C11H11ClN2OS/c1-6-4-9(7(2)3-8(6)12)16-10-5-13-14-11(10)15/h3-5,10H,1-2H3,(H,14,15)