4-azanyl-2-(3-methylsulfanylpropyl)isoindole-1,3-dione

Systemtic Name: 4-azanyl-2-(3-methylsulfanylpropyl)isoindole-1,3-dione Openeye Name: 4-amino-2-(3-methylsulfanylpropyl)isoindoline-1,3-dione CAS Name: 4-amino-2-[3-(methylthio)propyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-(3-methylsulfanylpropyl)isoindole-1,3-dione Traditional Name: 4-amino-2-[3-(methylthio)propyl]isoindoline-1,3-quinone Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCN1C(=O)C2=C(C1=O)C(=CC=C2)N

Isomeric SMILES

CSCCCN1C(=O)C2=C(C1=O)C(=CC=C2)N

InChI

InChI=1S/C12H14N2O2S/c1-17-7-3-6-14-11(15)8-4-2-5-9(13)10(8)12(14)16/h2,4-5H,3,6-7,13H2,1H3