3-(4-chloranyl-2,5-dimethyl-phenyl)sulfanyl-4-methyl-1H-pyrano[2,3-c]pyrazol-6-one

Systemtic Name: 3-(4-chloranyl-2,5-dimethyl-phenyl)sulfanyl-4-methyl-1H-pyrano[2,3-c]pyrazol-6-one Openeye Name: 3-(4-chloro-2,5-dimethyl-phenyl)sulfanyl-4-methyl-1H-pyrano[2,3-c]pyrazol-6-one CAS Name: 3-[(4-chloro-2,5-dimethylphenyl)thio]-4-methyl-1H-pyrano[2,3-c]pyrazol-6-one IUPAC Name: 3-(4-chloro-2,5-dimethylphenyl)sulfanyl-4-methyl-1H-pyrano[2,3-c]pyrazol-6-one Traditional Name: 3-[(4-chloro-2,5-dimethyl-phenyl)thio]-4-methyl-1H-pyrano[2,3-c]pyrazol-6-one Formula: C15H13ClN2O2S MolecularWeight: 320.79392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)SC2=NNC3=C2C(=CC(=O)O3)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)SC2=NNC3=C2C(=CC(=O)O3)C

InChI

InChI=1S/C15H13ClN2O2S/c1-7-5-11(8(2)4-10(7)16)21-15-13-9(3)6-12(19)20-14(13)17-18-15/h4-6H,1-3H3,(H,17,18)