methyl 3-[(3,5-dimethylphenyl)carbonylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[(3,5-dimethylphenyl)carbonylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[(3,5-dimethylbenzoyl)amino]-3-(2-thienyl)propanoate CAS Name: 3-[[(3,5-dimethylphenyl)-oxomethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[(3,5-dimethylbenzoyl)amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[(3,5-dimethylbenzoyl)amino]-3-(2-thienyl)propionic acid methyl ester Formula: C17H19NO3S MolecularWeight: 317.40266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC(CC(=O)OC)C2=CC=CS2)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC(CC(=O)OC)C2=CC=CS2)C

InChI

InChI=1S/C17H19NO3S/c1-11-7-12(2)9-13(8-11)17(20)18-14(10-16(19)21-3)15-5-4-6-22-15/h4-9,14H,10H2,1-3H3,(H,18,20)