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

Systemtic Name: [4-(3-methylpiperidin-1-yl)sulfonylphenyl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: [4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: [4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: [4-(3-methylpiperidin-1-yl)sulfonylphenyl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: [4-(3-methylpiperidino)sulfonylphenyl]-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C24H27N5O5S2 MolecularWeight: 529.63168

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H27N5O5S2/c1-17-3-2-10-28(16-17)36(33,34)20-7-4-18(5-8-20)23(30)26-11-13-27(14-12-26)24-25-21-9-6-19(29(31)32)15-22(21)35-24/h4-9,15,17H,2-3,10-14,16H2,1H3