methyl 2-[4-[(1,3,5-trimethylpyrazol-4-yl)carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[(1,3,5-trimethylpyrazol-4-yl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[(1,3,5-trimethylpyrazol-4-yl)carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[oxo-[(1,3,5-trimethyl-4-pyrazolyl)amino]methyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(1,3,5-trimethylpyrazol-4-yl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[(1,3,5-trimethylpyrazol-4-yl)carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C20H26N4O5S MolecularWeight: 434.50924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C20H26N4O5S/c1-13-18(14(2)23(3)22-13)21-19(25)15-9-11-24(12-10-15)30(27,28)17-8-6-5-7-16(17)20(26)29-4/h5-8,15H,9-12H2,1-4H3,(H,21,25)