N-(phenylmethyl)-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(phenylmethyl)-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-ethanamide Openeye Name: N-benzyl-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-acetamide CAS Name: N-(phenylmethyl)-2-[[4-(1-pyrrolidinylsulfonyl)phenyl]thio]acetamide IUPAC Name: N-benzyl-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanylacetamide Traditional Name: N-benzyl-2-[(4-pyrrolidinosulfonylphenyl)thio]acetamide Formula: C19H22N2O3S2 MolecularWeight: 390.51958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)SCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)SCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C19H22N2O3S2/c22-19(20-14-16-6-2-1-3-7-16)15-25-17-8-10-18(11-9-17)26(23,24)21-12-4-5-13-21/h1-3,6-11H,4-5,12-15H2,(H,20,22)