(2R)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-methyl-N-[(4-methylsulfanylphenyl)methyl]pyrrolidine-2-carboxamide

Systemtic Name: (2R)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-methyl-N-[(4-methylsulfanylphenyl)methyl]pyrrolidine-2-carboxamide Openeye Name: (2R)-1-[(5-bromo-2-thienyl)sulfonyl]-N-methyl-N-[(4-methylsulfanylphenyl)methyl]pyrrolidine-2-carboxamide CAS Name: (2R)-1-[(5-bromo-2-thiophenyl)sulfonyl]-N-methyl-N-[[4-(methylthio)phenyl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-(5-bromothiophen-2-yl)sulfonyl-N-methyl-N-[(4-methylsulfanylphenyl)methyl]pyrrolidine-2-carboxamide Traditional Name: (2R)-1-[(5-bromo-2-thienyl)sulfonyl]-N-methyl-N-[4-(methylthio)benzyl]pyrrolidine-2-carboxamide Formula: C18H21BrN2O3S3 MolecularWeight: 489.46994

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)C(=O)C2CCCN2S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)C(=O)[C@H]2CCCN2S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C18H21BrN2O3S3/c1-20(12-13-5-7-14(25-2)8-6-13)18(22)15-4-3-11-21(15)27(23,24)17-10-9-16(19)26-17/h5-10,15H,3-4,11-12H2,1-2H3/t15-/m1/s1