N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-methyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-2-methyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-1,3-diketo-2-methyl-isoindoline-5-carboxamide Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C20H17N3O3S/c1-23-19(25)16-7-6-13(10-17(16)20(23)26)18(24)22-8-9-27-12-15-5-3-2-4-14(15)11-21/h2-7,10H,8-9,12H2,1H3,(H,22,24)