butyl 4-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylthio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylthio]acetyl]amino]benzoic acid butyl ester Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSCC2=NOC(=N2)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSCC2=NOC(=N2)C

InChI

InChI=1S/C17H21N3O4S/c1-3-4-9-23-17(22)13-5-7-14(8-6-13)19-16(21)11-25-10-15-18-12(2)24-20-15/h5-8H,3-4,9-11H2,1-2H3,(H,19,21)