2-(4-chloranyl-5-methyl-2-tetradecyl-phenoxy)ethyl N-[4-methyl-1-(4-methylsulfonylphenyl)-5-oxidanylidene-4H-pyrazol-3-yl]carbamate

Systemtic Name: 2-(4-chloranyl-5-methyl-2-tetradecyl-phenoxy)ethyl N-[4-methyl-1-(4-methylsulfonylphenyl)-5-oxidanylidene-4H-pyrazol-3-yl]carbamate Openeye Name: 2-(4-chloro-5-methyl-2-tetradecyl-phenoxy)ethyl N-[4-methyl-1-(4-methylsulfonylphenyl)-5-oxo-4H-pyrazol-3-yl]carbamate CAS Name: N-[4-methyl-1-(4-methylsulfonylphenyl)-5-oxo-4H-pyrazol-3-yl]carbamic acid 2-(4-chloro-5-methyl-2-tetradecylphenoxy)ethyl ester IUPAC Name: 2-(4-chloro-5-methyl-2-tetradecylphenoxy)ethyl N-[4-methyl-1-(4-methylsulfonylphenyl)-5-oxo-4H-pyrazol-3-yl]carbamate Traditional Name: N-[5-keto-1-(4-mesylphenyl)-4-methyl-2-pyrazolin-3-yl]carbamic acid 2-(4-chloro-5-methyl-2-myristyl-phenoxy)ethyl ester Formula: C35H50ClN3O6S MolecularWeight: 676.306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=C(C=C(C(=C1)Cl)C)OCCOC(=O)NC2=NN(C(=O)C2C)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCC1=C(C=C(C(=C1)Cl)C)OCCOC(=O)NC2=NN(C(=O)C2C)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C35H50ClN3O6S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-28-25-31(36)26(2)24-32(28)44-22-23-45-35(41)37-33-27(3)34(40)39(38-33)29-18-20-30(21-19-29)46(4,42)43/h18-21,24-25,27H,5-17,22-23H2,1-4H3,(H,37,38,41)