N-[2-(4-bromophenyl)sulfanylethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(4-bromophenyl)sulfanylethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(4-bromophenyl)sulfanylethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-[(4-bromophenyl)thio]ethyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(4-bromophenyl)sulfanylethyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-[(4-bromophenyl)thio]ethyl]-3-pyrrolidinosulfonyl-benzamide Formula: C19H21BrN2O3S2 MolecularWeight: 469.41564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCSC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCSC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H21BrN2O3S2/c20-16-6-8-17(9-7-16)26-13-10-21-19(23)15-4-3-5-18(14-15)27(24,25)22-11-1-2-12-22/h3-9,14H,1-2,10-13H2,(H,21,23)