methyl 4-methylsulfanyl-2-[3-[5-(5-methylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]propanoylamino]butanoate

Systemtic Name: methyl 4-methylsulfanyl-2-[3-[5-(5-methylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]propanoylamino]butanoate Openeye Name: methyl 4-methylsulfanyl-2-[3-[5-(5-methyl-2-thienyl)-1,3,4-oxadiazol-2-yl]propanoylamino]butanoate CAS Name: 4-(methylthio)-2-[[3-[5-(5-methyl-2-thiophenyl)-1,3,4-oxadiazol-2-yl]-1-oxopropyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-methylsulfanyl-2-[3-[5-(5-methylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]propanoylamino]butanoate Traditional Name: 2-[3-[5-(5-methyl-2-thienyl)-1,3,4-oxadiazol-2-yl]propanoylamino]-4-(methylthio)butyric acid methyl ester Formula: C16H21N3O4S2 MolecularWeight: 383.48564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NN=C(O2)CCC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=CC=C(S1)C2=NN=C(O2)CCC(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C16H21N3O4S2/c1-10-4-5-12(25-10)15-19-18-14(23-15)7-6-13(20)17-11(8-9-24-3)16(21)22-2/h4-5,11H,6-9H2,1-3H3,(H,17,20)