N-(3-methylsulfanylphenyl)-3-(3-oxidanylidene-1H-isoindol-2-yl)-3-thiophen-2-yl-propanamide

Systemtic Name: N-(3-methylsulfanylphenyl)-3-(3-oxidanylidene-1H-isoindol-2-yl)-3-thiophen-2-yl-propanamide Openeye Name: N-(3-methylsulfanylphenyl)-3-(1-oxoisoindolin-2-yl)-3-(2-thienyl)propanamide CAS Name: N-[3-(methylthio)phenyl]-3-(3-oxo-1H-isoindol-2-yl)-3-thiophen-2-ylpropanamide IUPAC Name: N-(3-methylsulfanylphenyl)-3-(3-oxo-1H-isoindol-2-yl)-3-thiophen-2-ylpropanamide Traditional Name: 3-(1-ketoisoindolin-2-yl)-N-[3-(methylthio)phenyl]-3-(2-thienyl)propionamide Formula: C22H20N2O2S2 MolecularWeight: 408.5364

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CC(C2=CC=CS2)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CC(C2=CC=CS2)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H20N2O2S2/c1-27-17-8-4-7-16(12-17)23-21(25)13-19(20-10-5-11-28-20)24-14-15-6-2-3-9-18(15)22(24)26/h2-12,19H,13-14H2,1H3,(H,23,25)