methyl (3S)-3-[3-(5-phenyl-1,3-oxazol-2-yl)propanoylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl (3S)-3-[3-(5-phenyl-1,3-oxazol-2-yl)propanoylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl (3S)-3-[3-(5-phenyloxazol-2-yl)propanoylamino]-3-(2-thienyl)propanoate CAS Name: (3S)-3-[[1-oxo-3-(5-phenyl-2-oxazolyl)propyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl (3S)-3-[3-(5-phenyl-1,3-oxazol-2-yl)propanoylamino]-3-thiophen-2-ylpropanoate Traditional Name: (3S)-3-[3-(5-phenyloxazol-2-yl)propanoylamino]-3-(2-thienyl)propionic acid methyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)CCC2=NC=C(O2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C[C@@H](C1=CC=CS1)NC(=O)CCC2=NC=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O4S/c1-25-20(24)12-15(17-8-5-11-27-17)22-18(23)9-10-19-21-13-16(26-19)14-6-3-2-4-7-14/h2-8,11,13,15H,9-10,12H2,1H3,(H,22,23)/t15-/m0/s1