2-(4-nitrophenyl)sulfanyl-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide

Systemtic Name: 2-(4-nitrophenyl)sulfanyl-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide Openeye Name: N-[2-isopropoxy-5-(1-piperidylsulfonyl)phenyl]-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: 2-[(4-nitrophenyl)thio]-N-[5-(1-piperidinylsulfonyl)-2-propan-2-yloxyphenyl]acetamide IUPAC Name: 2-(4-nitrophenyl)sulfanyl-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxyphenyl)acetamide Traditional Name: N-(2-isopropoxy-5-piperidinosulfonyl-phenyl)-2-[(4-nitrophenyl)thio]acetamide Formula: C22H27N3O6S2 MolecularWeight: 493.59628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O6S2/c1-16(2)31-21-11-10-19(33(29,30)24-12-4-3-5-13-24)14-20(21)23-22(26)15-32-18-8-6-17(7-9-18)25(27)28/h6-11,14,16H,3-5,12-13,15H2,1-2H3,(H,23,26)