4-[(4-methoxyphenyl)methylsulfanyl]-1-methylsulfonyl-2-(phenoxymethyl)pyrrolidine

Systemtic Name: 4-[(4-methoxyphenyl)methylsulfanyl]-1-methylsulfonyl-2-(phenoxymethyl)pyrrolidine Openeye Name: 4-[(4-methoxyphenyl)methylsulfanyl]-1-methylsulfonyl-2-(phenoxymethyl)pyrrolidine CAS Name: 4-[(4-methoxyphenyl)methylthio]-1-methylsulfonyl-2-(phenoxymethyl)pyrrolidine IUPAC Name: 4-[(4-methoxyphenyl)methylsulfanyl]-1-methylsulfonyl-2-(phenoxymethyl)pyrrolidine Traditional Name: 1-mesyl-4-(p-anisylthio)-2-(phenoxymethyl)pyrrolidine Formula: C20H25NO4S2 MolecularWeight: 407.5468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2CC(N(C2)S(=O)(=O)C)COC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CSC2CC(N(C2)S(=O)(=O)C)COC3=CC=CC=C3

InChI

InChI=1S/C20H25NO4S2/c1-24-18-10-8-16(9-11-18)15-26-20-12-17(21(13-20)27(2,22)23)14-25-19-6-4-3-5-7-19/h3-11,17,20H,12-15H2,1-2H3