2-[4-(3-butyl-5-methyl-4-phenyl-pyrazol-1-yl)phenyl]ethyl N-(4-methylphenyl)sulfonylcarbamate

Systemtic Name: 2-[4-(3-butyl-5-methyl-4-phenyl-pyrazol-1-yl)phenyl]ethyl N-(4-methylphenyl)sulfonylcarbamate Openeye Name: 2-[4-(3-butyl-5-methyl-4-phenyl-pyrazol-1-yl)phenyl]ethyl N-(p-tolylsulfonyl)carbamate CAS Name: N-(4-methylphenyl)sulfonylcarbamic acid 2-[4-(3-butyl-5-methyl-4-phenyl-1-pyrazolyl)phenyl]ethyl ester IUPAC Name: 2-[4-(3-butyl-5-methyl-4-phenylpyrazol-1-yl)phenyl]ethyl N-(4-methylphenyl)sulfonylcarbamate Traditional Name: N-tosylcarbamic acid 2-[4-(3-butyl-5-methyl-4-phenyl-pyrazol-1-yl)phenyl]ethyl ester Formula: C30H33N3O4S MolecularWeight: 531.66572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN(C(=C1C2=CC=CC=C2)C)C3=CC=C(C=C3)CCOC(=O)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCC1=NN(C(=C1C2=CC=CC=C2)C)C3=CC=C(C=C3)CCOC(=O)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C30H33N3O4S/c1-4-5-11-28-29(25-9-7-6-8-10-25)23(3)33(31-28)26-16-14-24(15-17-26)20-21-37-30(34)32-38(35,36)27-18-12-22(2)13-19-27/h6-10,12-19H,4-5,11,20-21H2,1-3H3,(H,32,34)