methyl 3-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butanoylamino]thiophene-2-carboxylate CAS Name: 3-[[1-oxo-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoylamino]thiophene-2-carboxylate Traditional Name: 3-[4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butanoylamino]thiophene-2-carboxylic acid methyl ester Formula: C16H15N3O4S2 MolecularWeight: 377.438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)CCCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)CCCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C16H15N3O4S2/c1-22-16(21)14-10(7-9-25-14)17-12(20)5-2-6-13-18-15(19-23-13)11-4-3-8-24-11/h3-4,7-9H,2,5-6H2,1H3,(H,17,20)