(1-oxidanylidene-1-phenyl-propan-2-yl) 2-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 2-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 2-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-5-isoindolecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 2-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(5-methyl-1,3,4-thiadiazol-2-yl)isoindoline-5-carboxylic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C21H15N3O5S MolecularWeight: 421.4259

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC(C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(S1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC(C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H15N3O5S/c1-11(17(25)13-6-4-3-5-7-13)29-20(28)14-8-9-15-16(10-14)19(27)24(18(15)26)21-23-22-12(2)30-21/h3-11H,1-2H3