N-(2-methylsulfanylphenyl)-1,3-bis(oxidanylidene)-2-phenethyl-isoindole-5-carboxamide

Systemtic Name: N-(2-methylsulfanylphenyl)-1,3-bis(oxidanylidene)-2-phenethyl-isoindole-5-carboxamide Openeye Name: N-(2-methylsulfanylphenyl)-1,3-dioxo-2-phenethyl-isoindoline-5-carboxamide CAS Name: N-[2-(methylthio)phenyl]-1,3-dioxo-2-phenethyl-5-isoindolecarboxamide IUPAC Name: N-(2-methylsulfanylphenyl)-1,3-dioxo-2-phenethylisoindole-5-carboxamide Traditional Name: 1,3-diketo-N-[2-(methylthio)phenyl]-2-phenethyl-isoindoline-5-carboxamide Formula: C24H20N2O3S MolecularWeight: 416.4922

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCC4=CC=CC=C4

InChI

InChI=1S/C24H20N2O3S/c1-30-21-10-6-5-9-20(21)25-22(27)17-11-12-18-19(15-17)24(29)26(23(18)28)14-13-16-7-3-2-4-8-16/h2-12,15H,13-14H2,1H3,(H,25,27)