tert-butyl 2-[5-[(4-chlorophenyl)sulfonylcarbamoylamino]-4-cyano-3-methyl-pyrazol-1-yl]ethyl carbonate

Systemtic Name: tert-butyl 2-[5-[(4-chlorophenyl)sulfonylcarbamoylamino]-4-cyano-3-methyl-pyrazol-1-yl]ethyl carbonate Openeye Name: tert-butyl 2-[5-[(4-chlorophenyl)sulfonylcarbamoylamino]-4-cyano-3-methyl-pyrazol-1-yl]ethyl carbonate CAS Name: carbonic acid tert-butyl 2-[5-[[[(4-chlorophenyl)sulfonylamino]-oxomethyl]amino]-4-cyano-3-methyl-1-pyrazolyl]ethyl ester IUPAC Name: tert-butyl 2-[5-[(4-chlorophenyl)sulfonylcarbamoylamino]-4-cyano-3-methylpyrazol-1-yl]ethyl carbonate Traditional Name: carbonic acid tert-butyl 2-[5-[(4-chlorophenyl)sulfonylcarbamoylamino]-4-cyano-3-methyl-pyrazol-1-yl]ethyl ester Formula: C19H22ClN5O6S MolecularWeight: 483.92588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)Cl)CCOC(=O)OC(C)(C)C

Isomeric SMILES

CC1=NN(C(=C1C#N)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)Cl)CCOC(=O)OC(C)(C)C

InChI

InChI=1S/C19H22ClN5O6S/c1-12-15(11-21)16(25(23-12)9-10-30-18(27)31-19(2,3)4)22-17(26)24-32(28,29)14-7-5-13(20)6-8-14/h5-8H,9-10H2,1-4H3,(H2,22,24,26)