[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-3-yl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: [1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-3-yl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-[1-(1,5-dimethylpyrazol-4-yl)sulfonyl-3-piperidyl]methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-[1-[(1,5-dimethyl-4-pyrazolyl)sulfonyl]-3-piperidinyl]methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-3-yl]methanone Traditional Name: (4-besylpiperazino)-[1-(1,5-dimethylpyrazol-4-yl)sulfonyl-3-piperidyl]methanone Formula: C21H29N5O5S2 MolecularWeight: 495.61546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)S(=O)(=O)N2CCCC(C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=NN1C)S(=O)(=O)N2CCCC(C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H29N5O5S2/c1-17-20(15-22-23(17)2)33(30,31)26-10-6-7-18(16-26)21(27)24-11-13-25(14-12-24)32(28,29)19-8-4-3-5-9-19/h3-5,8-9,15,18H,6-7,10-14,16H2,1-2H3