(phenylmethyl) 4-[4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)pyrazol-1-yl]sulfonylpiperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)pyrazol-1-yl]sulfonylpiperidine-1-carboxylate Openeye Name: benzyl 4-[4-(2-acetamido-4-methyl-thiazol-5-yl)pyrazol-1-yl]sulfonylpiperidine-1-carboxylate CAS Name: 4-[[4-(2-acetamido-4-methyl-5-thiazolyl)-1-pyrazolyl]sulfonyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)pyrazol-1-yl]sulfonylpiperidine-1-carboxylate Traditional Name: 4-[4-(2-acetamido-4-methyl-thiazol-5-yl)pyrazol-1-yl]sulfonylpiperidine-1-carboxylic acid benzyl ester Formula: C22H25N5O5S2 MolecularWeight: 503.5944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C)C2=CN(N=C2)S(=O)(=O)C3CCN(CC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C)C2=CN(N=C2)S(=O)(=O)C3CCN(CC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C22H25N5O5S2/c1-15-20(33-21(24-15)25-16(2)28)18-12-23-27(13-18)34(30,31)19-8-10-26(11-9-19)22(29)32-14-17-6-4-3-5-7-17/h3-7,12-13,19H,8-11,14H2,1-2H3,(H,24,25,28)