[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate Openeye Name: [2-oxo-2-(4-phenylazoanilino)ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate CAS Name: 5-methyl-4-propyl-2-thiophenecarboxylic acid [2-oxo-2-(4-phenyldiazenylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenyldiazenylanilino)ethyl] 5-methyl-4-propylthiophene-2-carboxylate Traditional Name: 5-methyl-4-propyl-thiophene-2-carboxylic acid [2-keto-2-(4-phenylazoanilino)ethyl] ester Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SC(=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3)C

Isomeric SMILES

CCCC1=C(SC(=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3)C

InChI

InChI=1S/C23H23N3O3S/c1-3-7-17-14-21(30-16(17)2)23(28)29-15-22(27)24-18-10-12-20(13-11-18)26-25-19-8-5-4-6-9-19/h4-6,8-14H,3,7,15H2,1-2H3,(H,24,27)