[4-(2,4-dichlorophenyl)carbonyl-2,5-dimethyl-pyrazol-3-yl] (phenylmethylsulfanyl)methanoate

Systemtic Name: [4-(2,4-dichlorophenyl)carbonyl-2,5-dimethyl-pyrazol-3-yl] (phenylmethylsulfanyl)methanoate Openeye Name: [4-(2,4-dichlorobenzoyl)-2,5-dimethyl-pyrazol-3-yl] benzylsulfanylformate CAS Name: (phenylmethylthio)formic acid [4-[(2,4-dichlorophenyl)-oxomethyl]-2,5-dimethyl-3-pyrazolyl] ester IUPAC Name: [4-(2,4-dichlorobenzoyl)-2,5-dimethylpyrazol-3-yl] benzylsulfanylformate Traditional Name: (benzylthio)formic acid [4-(2,4-dichlorobenzoyl)-2,5-dimethyl-pyrazol-3-yl] ester Formula: C20H16Cl2N2O3S MolecularWeight: 435.32364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)C2=C(C=C(C=C2)Cl)Cl)OC(=O)SCC3=CC=CC=C3)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)C2=C(C=C(C=C2)Cl)Cl)OC(=O)SCC3=CC=CC=C3)C

InChI

InChI=1S/C20H16Cl2N2O3S/c1-12-17(18(25)15-9-8-14(21)10-16(15)22)19(24(2)23-12)27-20(26)28-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3