2-methoxy-4-methylsulfanyl-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]benzamide

Systemtic Name: 2-methoxy-4-methylsulfanyl-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]benzamide Openeye Name: 2-methoxy-4-methylsulfanyl-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]benzamide CAS Name: 2-methoxy-4-(methylthio)-N-[2-[4-(1-pyrrolidinylsulfonyl)phenyl]ethyl]benzamide IUPAC Name: 2-methoxy-4-methylsulfanyl-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]benzamide Traditional Name: 2-methoxy-4-(methylthio)-N-[2-(4-pyrrolidinosulfonylphenyl)ethyl]benzamide Formula: C21H26N2O4S2 MolecularWeight: 434.57214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H26N2O4S2/c1-27-20-15-17(28-2)7-10-19(20)21(24)22-12-11-16-5-8-18(9-6-16)29(25,26)23-13-3-4-14-23/h5-10,15H,3-4,11-14H2,1-2H3,(H,22,24)