methyl 5-phenyl-2-(3-phenylprop-2-ynoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-phenyl-2-(3-phenylprop-2-ynoylamino)thiophene-3-carboxylate Openeye Name: methyl 5-phenyl-2-(3-phenylprop-2-ynoylamino)thiophene-3-carboxylate CAS Name: 2-[(1-oxo-3-phenylprop-2-ynyl)amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-phenyl-2-(3-phenylprop-2-ynoylamino)thiophene-3-carboxylate Traditional Name: 5-phenyl-2-[(3-phenylpropioloyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C21H15NO3S MolecularWeight: 361.4137

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C#CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C#CC3=CC=CC=C3

InChI

InChI=1S/C21H15NO3S/c1-25-21(24)17-14-18(16-10-6-3-7-11-16)26-20(17)22-19(23)13-12-15-8-4-2-5-9-15/h2-11,14H,1H3,(H,22,23)