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

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (2-anilino-2-oxo-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 (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 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-anilino-2-keto-ethyl) ester Formula: C20H14N4O5S MolecularWeight: 422.41396

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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)OCC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(S1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C20H14N4O5S/c1-11-22-23-20(30-11)24-17(26)14-8-7-12(9-15(14)18(24)27)19(28)29-10-16(25)21-13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H,21,25)