N-(2-ethylsulfanylphenyl)-4-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-ethylsulfanylphenyl)-4-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-ethylsulfanylphenyl)-4-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(ethylthio)phenyl]-4-methyl-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2-ethylsulfanylphenyl)-4-methyl-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(ethylthio)phenyl]-4-methyl-3-pyrrolidinosulfonyl-benzamide Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCSC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCCC3

InChI

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