N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzamide

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzamide Openeye Name: N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-2-[[(2R)-tetrahydrofuran-2-yl]methylsulfanyl]benzamide CAS Name: N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-2-[[(2R)-2-oxolanyl]methylthio]benzamide IUPAC Name: N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzamide Traditional Name: N-(4-methyl-3-piperidinosulfonyl-phenyl)-2-[[(2R)-tetrahydrofuran-2-yl]methylthio]benzamide Formula: C24H30N2O4S2 MolecularWeight: 474.636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC3CCCO3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SC[C@H]3CCCO3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C24H30N2O4S2/c1-18-11-12-19(16-23(18)32(28,29)26-13-5-2-6-14-26)25-24(27)21-9-3-4-10-22(21)31-17-20-8-7-15-30-20/h3-4,9-12,16,20H,2,5-8,13-15,17H2,1H3,(H,25,27)/t20-/m1/s1