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

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

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCN1S(=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/c1-17-4-2-3-11-28(17)36(33,34)20-8-5-18(6-9-20)23(30)26-12-14-27(15-13-26)24-25-21-10-7-19(29(31)32)16-22(21)35-24/h5-10,16-17H,2-4,11-15H2,1H3