ethyl 4,5-dimethyl-2-[[3-phenyl-2-(phenylmethyl)propanoyl]amino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[[3-phenyl-2-(phenylmethyl)propanoyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-benzyl-3-phenyl-propanoyl)amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-3-phenyl-2-(phenylmethyl)propyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-benzyl-3-phenylpropanoyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(2-benzyl-3-phenyl-propanoyl)amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H27NO3S MolecularWeight: 421.55178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C25H27NO3S/c1-4-29-25(28)22-17(2)18(3)30-24(22)26-23(27)21(15-19-11-7-5-8-12-19)16-20-13-9-6-10-14-20/h5-14,21H,4,15-16H2,1-3H3,(H,26,27)