2-[(2-azanyl-4-methyl-1,3-thiazol-5-yl)sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[(2-azanyl-4-methyl-1,3-thiazol-5-yl)sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[(2-amino-4-methyl-thiazol-5-yl)sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[(2-amino-4-methyl-5-thiazolyl)thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[(2-amino-4-methyl-1,3-thiazol-5-yl)sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[(2-amino-4-methyl-thiazol-5-yl)thio]methyl]isoindoline-1,3-quinone Formula: C13H11N3O2S2 MolecularWeight: 305.37534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N)SCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=C(SC(=N1)N)SCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C13H11N3O2S2/c1-7-12(20-13(14)15-7)19-6-16-10(17)8-4-2-3-5-9(8)11(16)18/h2-5H,6H2,1H3,(H2,14,15)