methyl 4-methyl-5-(phenylmethyl)-2-(3-phenylpropanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-methyl-5-(phenylmethyl)-2-(3-phenylpropanoylamino)thiophene-3-carboxylate Openeye Name: methyl 5-benzyl-4-methyl-2-(3-phenylpropanoylamino)thiophene-3-carboxylate CAS Name: 4-methyl-2-[(1-oxo-3-phenylpropyl)amino]-5-(phenylmethyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-benzyl-4-methyl-2-(3-phenylpropanoylamino)thiophene-3-carboxylate Traditional Name: 5-benzyl-2-(hydrocinnamoylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C23H23NO3S MolecularWeight: 393.49862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C23H23NO3S/c1-16-19(15-18-11-7-4-8-12-18)28-22(21(16)23(26)27-2)24-20(25)14-13-17-9-5-3-6-10-17/h3-12H,13-15H2,1-2H3,(H,24,25)