[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 2-acetamido-1,3-thiazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 2-acetamido-1,3-thiazole-4-carboxylate Openeye Name: [2-oxo-2-(4-phenylazoanilino)ethyl] 2-acetamidothiazole-4-carboxylate CAS Name: 2-acetamido-4-thiazolecarboxylic acid [2-oxo-2-(4-phenyldiazenylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenyldiazenylanilino)ethyl] 2-acetamido-1,3-thiazole-4-carboxylate Traditional Name: 2-acetamidothiazole-4-carboxylic acid [2-keto-2-(4-phenylazoanilino)ethyl] ester Formula: C20H17N5O4S MolecularWeight: 423.44508

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)C(=O)OCC(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=NC(=CS1)C(=O)OCC(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3

InChI

InChI=1S/C20H17N5O4S/c1-13(26)21-20-23-17(12-30-20)19(28)29-11-18(27)22-14-7-9-16(10-8-14)25-24-15-5-3-2-4-6-15/h2-10,12H,11H2,1H3,(H,22,27)(H,21,23,26)