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

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(p-tolylsulfanyl)ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(p-tolylthio)ethyl]-4-pyrrolidinosulfonyl-benzamide Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H24N2O3S2/c1-16-4-8-18(9-5-16)26-15-12-21-20(23)17-6-10-19(11-7-17)27(24,25)22-13-2-3-14-22/h4-11H,2-3,12-15H2,1H3,(H,21,23)