methyl 5-methylsulfanyl-4-[2-[(4-phenyldiazenylphenyl)amino]-1,3-thiazol-4-yl]thiophene-2-carboxylate

Systemtic Name: methyl 5-methylsulfanyl-4-[2-[(4-phenyldiazenylphenyl)amino]-1,3-thiazol-4-yl]thiophene-2-carboxylate Openeye Name: methyl 5-methylsulfanyl-4-[2-(4-phenylazoanilino)thiazol-4-yl]thiophene-2-carboxylate CAS Name: 5-(methylthio)-4-[2-(4-phenyldiazenylanilino)-4-thiazolyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methylsulfanyl-4-[2-(4-phenyldiazenylanilino)-1,3-thiazol-4-yl]thiophene-2-carboxylate Traditional Name: 5-(methylthio)-4-[2-(4-phenylazoanilino)thiazol-4-yl]thiophene-2-carboxylic acid methyl ester Formula: C22H18N4O2S3 MolecularWeight: 466.59892

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)SC)C2=CSC(=N2)NC3=CC=C(C=C3)N=NC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=C(S1)SC)C2=CSC(=N2)NC3=CC=C(C=C3)N=NC4=CC=CC=C4

InChI

InChI=1S/C22H18N4O2S3/c1-28-20(27)19-12-17(21(29-2)31-19)18-13-30-22(24-18)23-14-8-10-16(11-9-14)26-25-15-6-4-3-5-7-15/h3-13H,1-2H3,(H,23,24)