N-ethyl-4-[2-[(2-thiophen-3-ylphenyl)methylsulfinyl]ethanoyl]piperazine-1-carboxamide

Systemtic Name: N-ethyl-4-[2-[(2-thiophen-3-ylphenyl)methylsulfinyl]ethanoyl]piperazine-1-carboxamide Openeye Name: N-ethyl-4-[2-[[2-(3-thienyl)phenyl]methylsulfinyl]acetyl]piperazine-1-carboxamide CAS Name: N-ethyl-4-[1-oxo-2-[[2-(3-thiophenyl)phenyl]methylsulfinyl]ethyl]-1-piperazinecarboxamide IUPAC Name: N-ethyl-4-[2-[(2-thiophen-3-ylphenyl)methylsulfinyl]acetyl]piperazine-1-carboxamide Traditional Name: N-ethyl-4-[2-[2-(3-thienyl)benzyl]sulfinylacetyl]piperazine-1-carboxamide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN(CC1)C(=O)CS(=O)CC2=CC=CC=C2C3=CSC=C3

Isomeric SMILES

CCNC(=O)N1CCN(CC1)C(=O)CS(=O)CC2=CC=CC=C2C3=CSC=C3

InChI

InChI=1S/C20H25N3O3S2/c1-2-21-20(25)23-10-8-22(9-11-23)19(24)15-28(26)14-17-5-3-4-6-18(17)16-7-12-27-13-16/h3-7,12-13H,2,8-11,14-15H2,1H3,(H,21,25)