methyl (2S)-2-[(2,5-dimethylthiophen-3-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(2,5-dimethylthiophen-3-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(2,5-dimethylthiophene-3-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2,5-dimethyl-3-thiophenyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2,5-dimethylthiophene-3-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(2,5-dimethylthiophene-3-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C17H19NO3S MolecularWeight: 317.40266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C17H19NO3S/c1-11-9-14(12(2)22-11)16(19)18-15(17(20)21-3)10-13-7-5-4-6-8-13/h4-9,15H,10H2,1-3H3,(H,18,19)/t15-/m0/s1