5-[[1,1-bis(oxidanylidene)thian-4-yl]amino]-2-methyl-isoindole-1,3-dione

Systemtic Name: 5-[[1,1-bis(oxidanylidene)thian-4-yl]amino]-2-methyl-isoindole-1,3-dione Openeye Name: 5-[(1,1-dioxothian-4-yl)amino]-2-methyl-isoindoline-1,3-dione CAS Name: 5-[(1,1-dioxo-4-thianyl)amino]-2-methylisoindole-1,3-dione IUPAC Name: 5-[(1,1-dioxothian-4-yl)amino]-2-methylisoindole-1,3-dione Traditional Name: 5-[(1,1-diketothian-4-yl)amino]-2-methyl-isoindoline-1,3-quinone Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC3CCS(=O)(=O)CC3

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC3CCS(=O)(=O)CC3

InChI

InChI=1S/C14H16N2O4S/c1-16-13(17)11-3-2-10(8-12(11)14(16)18)15-9-4-6-21(19,20)7-5-9/h2-3,8-9,15H,4-7H2,1H3