methyl (3S)-3-[2-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (3S)-3-[2-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl (3S)-3-[[2-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]acetyl]amino]-3-phenyl-propanoate CAS Name: (3S)-3-[[1-oxo-2-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)ethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (3S)-3-[[2-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)acetyl]amino]-3-phenylpropanoate Traditional Name: (3S)-3-[[2-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)CN2C(=O)OC(=N2)C3=CC=CS3

Isomeric SMILES

COC(=O)C[C@@H](C1=CC=CC=C1)NC(=O)CN2C(=O)OC(=N2)C3=CC=CS3

InChI

InChI=1S/C18H17N3O5S/c1-25-16(23)10-13(12-6-3-2-4-7-12)19-15(22)11-21-18(24)26-17(20-21)14-8-5-9-27-14/h2-9,13H,10-11H2,1H3,(H,19,22)/t13-/m0/s1