[1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: [1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: [1-(4-methoxyphenyl)sulfonyl-3-piperidyl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: [1-(4-methoxyphenyl)sulfonyl-3-piperidinyl]-[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: [1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: [1-(4-methoxyphenyl)sulfonyl-3-piperidyl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C24H27N5O6S2 MolecularWeight: 545.63108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H27N5O6S2/c1-35-19-5-7-20(8-6-19)37(33,34)28-10-2-3-17(16-28)23(30)26-11-13-27(14-12-26)24-25-21-9-4-18(29(31)32)15-22(21)36-24/h4-9,15,17H,2-3,10-14,16H2,1H3