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

Systemtic Name: methyl 5-methylsulfanyl-4-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxylate Openeye Name: methyl 5-methylsulfanyl-4-[[4-(4-phenylphenyl)thiazol-2-yl]amino]thiophene-2-carboxylate CAS Name: 5-(methylthio)-4-[[4-(4-phenylphenyl)-2-thiazolyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methylsulfanyl-4-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxylate Traditional Name: 5-(methylthio)-4-[[4-(4-phenylphenyl)thiazol-2-yl]amino]thiophene-2-carboxylic acid methyl ester Formula: C22H18N2O2S3 MolecularWeight: 438.58552

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)SC)NC2=NC(=CS2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=C(S1)SC)NC2=NC(=CS2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O2S3/c1-26-20(25)19-12-17(21(27-2)29-19)23-22-24-18(13-28-22)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-13H,1-2H3,(H,23,24)