4-methoxy-N-(3-methylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-methoxy-N-(3-methylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-methoxy-N-(3-methylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-methoxy-N-[3-(methylthio)phenyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-methoxy-N-(3-methylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-methoxy-N-[3-(methylthio)phenyl]-3-pyrrolidinosulfonyl-benzamide Formula: C19H22N2O4S2 MolecularWeight: 406.51898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)SC)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)SC)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H22N2O4S2/c1-25-17-9-8-14(12-18(17)27(23,24)21-10-3-4-11-21)19(22)20-15-6-5-7-16(13-15)26-2/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,20,22)