N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-4-phenyl-oxane-4-carboxamide

Systemtic Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-4-phenyl-oxane-4-carboxamide Openeye Name: 4-phenyl-N-[2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]tetrahydropyran-4-carboxamide CAS Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-4-phenyl-4-oxanecarboxamide IUPAC Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-4-phenyloxane-4-carboxamide Traditional Name: 4-phenyl-N-[2-(2-thienyl)-2-tosyl-ethyl]tetrahydropyran-4-carboxamide Formula: C25H27NO4S2 MolecularWeight: 469.61618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C2(CCOCC2)C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C2(CCOCC2)C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C25H27NO4S2/c1-19-9-11-21(12-10-19)32(28,29)23(22-8-5-17-31-22)18-26-24(27)25(13-15-30-16-14-25)20-6-3-2-4-7-20/h2-12,17,23H,13-16,18H2,1H3,(H,26,27)