3,5-bis(oxan-2-ylsulfanylmethyl)-1-(phenylmethyl)pyrrolidin-2-one

Systemtic Name: 3,5-bis(oxan-2-ylsulfanylmethyl)-1-(phenylmethyl)pyrrolidin-2-one Openeye Name: 1-benzyl-3,5-bis(tetrahydropyran-2-ylsulfanylmethyl)pyrrolidin-2-one CAS Name: 3,5-bis[(2-oxanylthio)methyl]-1-(phenylmethyl)-2-pyrrolidinone IUPAC Name: 1-benzyl-3,5-bis(oxan-2-ylsulfanylmethyl)pyrrolidin-2-one Traditional Name: 1-benzyl-3,5-bis[(tetrahydropyran-2-ylthio)methyl]-2-pyrrolidone Formula: C23H33NO3S2 MolecularWeight: 435.64302

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)SCC2CC(N(C2=O)CC3=CC=CC=C3)CSC4CCCCO4

Isomeric SMILES

C1CCOC(C1)SCC2CC(N(C2=O)CC3=CC=CC=C3)CSC4CCCCO4

InChI

InChI=1S/C23H33NO3S2/c25-23-19(16-28-21-10-4-6-12-26-21)14-20(17-29-22-11-5-7-13-27-22)24(23)15-18-8-2-1-3-9-18/h1-3,8-9,19-22H,4-7,10-17H2