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

Systemtic Name: [1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: [1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: [1-(4-methoxyphenyl)sulfonyl-2-pyrrolidinyl]-[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: [1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: [1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C23H25N5O6S2 MolecularWeight: 531.6045

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H25N5O6S2/c1-34-17-5-7-18(8-6-17)36(32,33)27-10-2-3-20(27)22(29)25-11-13-26(14-12-25)23-24-19-9-4-16(28(30)31)15-21(19)35-23/h4-9,15,20H,2-3,10-14H2,1H3