2-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone Openeye Name: 2-[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)-1-[4-(2-thenoyl)piperazino]ethanone Formula: C21H29N5O4S2 MolecularWeight: 479.61606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)C)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)C)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H29N5O4S2/c1-16-20(32(29,30)25-8-4-3-5-9-25)17(2)26(22-16)15-19(27)23-10-12-24(13-11-23)21(28)18-7-6-14-31-18/h6-7,14H,3-5,8-13,15H2,1-2H3