N'-(2-methylsulfanylphenyl)-N-(2-pyrrolidin-1-yl-2-thiophen-3-yl-ethyl)ethanediamide

Systemtic Name: N'-(2-methylsulfanylphenyl)-N-(2-pyrrolidin-1-yl-2-thiophen-3-yl-ethyl)ethanediamide Openeye Name: N'-(2-methylsulfanylphenyl)-N-[2-pyrrolidin-1-yl-2-(3-thienyl)ethyl]oxamide CAS Name: N'-[2-(methylthio)phenyl]-N-[2-(1-pyrrolidinyl)-2-(3-thiophenyl)ethyl]oxamide IUPAC Name: N'-(2-methylsulfanylphenyl)-N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)oxamide Traditional Name: N'-[2-(methylthio)phenyl]-N-[2-pyrrolidino-2-(3-thienyl)ethyl]oxamide Formula: C19H23N3O2S2 MolecularWeight: 389.53482

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C(=O)NCC(C2=CSC=C2)N3CCCC3

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C(=O)NCC(C2=CSC=C2)N3CCCC3

InChI

InChI=1S/C19H23N3O2S2/c1-25-17-7-3-2-6-15(17)21-19(24)18(23)20-12-16(14-8-11-26-13-14)22-9-4-5-10-22/h2-3,6-8,11,13,16H,4-5,9-10,12H2,1H3,(H,20,23)(H,21,24)