5-(2-chloranylbutan-2-yl)-4-sulfanylidene-5H-isoindole-1,3-dione

Systemtic Name: 5-(2-chloranylbutan-2-yl)-4-sulfanylidene-5H-isoindole-1,3-dione Openeye Name: 5-(1-chloro-1-methyl-propyl)-4-thioxo-5H-isoindole-1,3-dione CAS Name: 5-(2-chlorobutan-2-yl)-4-sulfanylidene-5H-isoindole-1,3-dione IUPAC Name: 5-(2-chlorobutan-2-yl)-4-sulfanylidene-5H-isoindole-1,3-dione Traditional Name: 5-(1-chloro-1-methyl-propyl)-4-thioxo-5H-isoindole-1,3-quinone Formula: C12H12ClNO2S MolecularWeight: 269.74718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C1C=CC2=C(C1=S)C(=O)NC2=O)Cl

Isomeric SMILES

CCC(C)(C1C=CC2=C(C1=S)C(=O)NC2=O)Cl

InChI

InChI=1S/C12H12ClNO2S/c1-3-12(2,13)7-5-4-6-8(9(7)17)11(16)14-10(6)15/h4-5,7H,3H2,1-2H3,(H,14,15,16)