2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-pyrrolidin-1-ylsulfonyl-pyridine

Systemtic Name: 2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-pyrrolidin-1-ylsulfonyl-pyridine Openeye Name: 2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-pyrrolidin-1-ylsulfonyl-pyridine CAS Name: 2-[(4,5-dimethoxy-2-methylphenyl)methylthio]-5-(1-pyrrolidinylsulfonyl)pyridine IUPAC Name: 2-[(4,5-dimethoxy-2-methylphenyl)methylsulfanyl]-5-pyrrolidin-1-ylsulfonylpyridine Traditional Name: 2-[(4,5-dimethoxy-2-methyl-benzyl)thio]-5-pyrrolidinosulfonyl-pyridine Formula: C19H24N2O4S2 MolecularWeight: 408.53486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CSC2=NC=C(C=C2)S(=O)(=O)N3CCCC3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CSC2=NC=C(C=C2)S(=O)(=O)N3CCCC3)OC)OC

InChI

InChI=1S/C19H24N2O4S2/c1-14-10-17(24-2)18(25-3)11-15(14)13-26-19-7-6-16(12-20-19)27(22,23)21-8-4-5-9-21/h6-7,10-12H,4-5,8-9,13H2,1-3H3