2-[4-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]piperazin-1-yl]-N-(2-methylpropyl)ethanamide

Systemtic Name: 2-[4-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]piperazin-1-yl]-N-(2-methylpropyl)ethanamide Openeye Name: N-isobutyl-2-[4-[4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-phenyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitrophenyl]-1-piperazinyl]-N-(2-methylpropyl)acetamide IUPAC Name: 2-[4-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitrophenyl]piperazin-1-yl]-N-(2-methylpropyl)acetamide Traditional Name: N-isobutyl-2-[4-[4-(4-methylpiperidino)sulfonyl-2-nitro-phenyl]piperazino]acetamide Formula: C22H35N5O5S MolecularWeight: 481.6088

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC(=O)NCC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC(=O)NCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H35N5O5S/c1-17(2)15-23-22(28)16-24-10-12-25(13-11-24)20-5-4-19(14-21(20)27(29)30)33(31,32)26-8-6-18(3)7-9-26/h4-5,14,17-18H,6-13,15-16H2,1-3H3,(H,23,28)