methyl 2-[(3,5-dimethylphenyl)carbonyl-ethyl-amino]-2-methyl-3-(4-thiophen-3-ylphenyl)propanoate

Systemtic Name: methyl 2-[(3,5-dimethylphenyl)carbonyl-ethyl-amino]-2-methyl-3-(4-thiophen-3-ylphenyl)propanoate Openeye Name: methyl 2-[(3,5-dimethylbenzoyl)-ethyl-amino]-2-methyl-3-[4-(3-thienyl)phenyl]propanoate CAS Name: 2-[[(3,5-dimethylphenyl)-oxomethyl]-ethylamino]-2-methyl-3-[4-(3-thiophenyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-[(3,5-dimethylbenzoyl)-ethylamino]-2-methyl-3-(4-thiophen-3-ylphenyl)propanoate Traditional Name: 2-[(3,5-dimethylbenzoyl)-ethyl-amino]-2-methyl-3-[4-(3-thienyl)phenyl]propionic acid methyl ester Formula: C26H29NO3S MolecularWeight: 435.57836

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)C1=CC(=CC(=C1)C)C)C(C)(CC2=CC=C(C=C2)C3=CSC=C3)C(=O)OC

Isomeric SMILES

CCN(C(=O)C1=CC(=CC(=C1)C)C)C(C)(CC2=CC=C(C=C2)C3=CSC=C3)C(=O)OC

InChI

InChI=1S/C26H29NO3S/c1-6-27(24(28)23-14-18(2)13-19(3)15-23)26(4,25(29)30-5)16-20-7-9-21(10-8-20)22-11-12-31-17-22/h7-15,17H,6,16H2,1-5H3