methyl 4-[[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonyl-pyrazol-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonyl-pyrazol-1-yl]methyl]benzoate Openeye Name: methyl 4-[[3,5-dimethyl-4-[(4-methyl-1-piperidyl)sulfonyl]pyrazol-1-yl]methyl]benzoate CAS Name: 4-[[3,5-dimethyl-4-[(4-methyl-1-piperidinyl)sulfonyl]-1-pyrazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonylpyrazol-1-yl]methyl]benzoate Traditional Name: 4-[[3,5-dimethyl-4-(4-methylpiperidino)sulfonyl-pyrazol-1-yl]methyl]benzoic acid methyl ester Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(N(N=C2C)CC3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(N(N=C2C)CC3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C20H27N3O4S/c1-14-9-11-22(12-10-14)28(25,26)19-15(2)21-23(16(19)3)13-17-5-7-18(8-6-17)20(24)27-4/h5-8,14H,9-13H2,1-4H3