2-(4-azanyl-2-methyl-phenyl)-5-methylsulfinyl-isoindole-1,3-dione

Systemtic Name: 2-(4-azanyl-2-methyl-phenyl)-5-methylsulfinyl-isoindole-1,3-dione Openeye Name: 2-(4-amino-2-methyl-phenyl)-5-methylsulfinyl-isoindoline-1,3-dione CAS Name: 2-(4-amino-2-methylphenyl)-5-methylsulfinylisoindole-1,3-dione IUPAC Name: 2-(4-amino-2-methylphenyl)-5-methylsulfinylisoindole-1,3-dione Traditional Name: 2-(4-amino-2-methyl-phenyl)-5-methylsulfinyl-isoindoline-1,3-quinone Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)N2C(=O)C3=C(C2=O)C=C(C=C3)S(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)N)N2C(=O)C3=C(C2=O)C=C(C=C3)S(=O)C

InChI

InChI=1S/C16H14N2O3S/c1-9-7-10(17)3-6-14(9)18-15(19)12-5-4-11(22(2)21)8-13(12)16(18)20/h3-8H,17H2,1-2H3