N-(1-methylsulfonylpiperidin-4-yl)-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-(1-methylsulfonylpiperidin-4-yl)-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-(1-methylsulfonyl-4-piperidyl)-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-(1-methylsulfonyl-4-piperidinyl)-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-(1-methylsulfonylpiperidin-4-yl)-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-(1-mesyl-4-piperidyl)-2-[(4-nitrophenyl)thio]acetamide Formula: C14H19N3O5S2 MolecularWeight: 373.44776

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O5S2/c1-24(21,22)16-8-6-11(7-9-16)15-14(18)10-23-13-4-2-12(3-5-13)17(19)20/h2-5,11H,6-10H2,1H3,(H,15,18)