2-[4-[4-(4-cyclohexylpiperazin-1-yl)carbonylpiperidin-1-yl]sulfonyl-3,5-dimethyl-pyrazol-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[4-(4-cyclohexylpiperazin-1-yl)carbonylpiperidin-1-yl]sulfonyl-3,5-dimethyl-pyrazol-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[[4-(4-cyclohexylpiperazine-1-carbonyl)-1-piperidyl]sulfonyl]-3,5-dimethyl-pyrazol-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[[4-[(4-cyclohexyl-1-piperazinyl)-oxomethyl]-1-piperidinyl]sulfonyl]-3,5-dimethyl-1-pyrazolyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[4-(4-cyclohexylpiperazine-1-carbonyl)piperidin-1-yl]sulfonyl-3,5-dimethylpyrazol-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[4-(4-cyclohexylpiperazine-1-carbonyl)piperidino]sulfonyl-3,5-dimethyl-pyrazol-1-yl]-1-pyrrolidino-ethanone Formula: C27H44N6O4S MolecularWeight: 548.74106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2CCCC2)C)S(=O)(=O)N3CCC(CC3)C(=O)N4CCN(CC4)C5CCCCC5

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2CCCC2)C)S(=O)(=O)N3CCC(CC3)C(=O)N4CCN(CC4)C5CCCCC5

InChI

InChI=1S/C27H44N6O4S/c1-21-26(22(2)33(28-21)20-25(34)30-12-6-7-13-30)38(36,37)32-14-10-23(11-15-32)27(35)31-18-16-29(17-19-31)24-8-4-3-5-9-24/h23-24H,3-20H2,1-2H3