2-[1-methyl-2-(4-methyl-5-sulfanyl-5H-1,2,3,4-tetrazol-1-yl)-4-oxidanylidene-azetidin-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-methyl-2-(4-methyl-5-sulfanyl-5H-1,2,3,4-tetrazol-1-yl)-4-oxidanylidene-azetidin-3-yl]isoindole-1,3-dione Openeye Name: 2-[1-methyl-2-(4-methyl-5-sulfanyl-5H-tetrazol-1-yl)-4-oxo-azetidin-3-yl]isoindoline-1,3-dione CAS Name: 2-[2-(5-mercapto-4-methyl-5H-tetrazol-1-yl)-1-methyl-4-oxo-3-azetidinyl]isoindole-1,3-dione IUPAC Name: 2-[1-methyl-2-(4-methyl-5-sulfanyl-5H-tetrazol-1-yl)-4-oxoazetidin-3-yl]isoindole-1,3-dione Traditional Name: 2-[2-keto-4-(5-mercapto-4-methyl-5H-tetrazol-1-yl)-1-methyl-azetidin-3-yl]isoindoline-1,3-quinone Formula: C14H14N6O3S MolecularWeight: 346.36436

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C1=O)N2C(=O)C3=CC=CC=C3C2=O)N4C(N(N=N4)C)S

Isomeric SMILES

CN1C(C(C1=O)N2C(=O)C3=CC=CC=C3C2=O)N4C(N(N=N4)C)S

InChI

InChI=1S/C14H14N6O3S/c1-17-10(20-14(24)18(2)15-16-20)9(13(17)23)19-11(21)7-5-3-4-6-8(7)12(19)22/h3-6,9-10,14,24H,1-2H3