2-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]isoindole-1,3-dione Openeye Name: 2-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]isoindoline-1,3-dione CAS Name: 2-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]isoindole-1,3-dione Traditional Name: 2-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetyl]isoindoline-1,3-quinone Formula: C13H10N4O3S MolecularWeight: 302.3085

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CN1C=NN=C1SCC(=O)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C13H10N4O3S/c1-16-7-14-15-13(16)21-6-10(18)17-11(19)8-4-2-3-5-9(8)12(17)20/h2-5,7H,6H2,1H3