3-[2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoylamino]benzoate

Systemtic Name: 3-[2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoylamino]benzoate Openeye Name: 3-[[2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 3-[[1-oxo-2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]thio]ethyl]amino]benzoate IUPAC Name: 3-[[2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 3-[[2-[(5-benzyl-1,3,4-oxadiazol-2-yl)thio]acetyl]amino]benzoate Formula: C18H14N3O4S- MolecularWeight: 368.38646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(O2)SCC(=O)NC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(O2)SCC(=O)NC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C18H15N3O4S/c22-15(19-14-8-4-7-13(10-14)17(23)24)11-26-18-21-20-16(25-18)9-12-5-2-1-3-6-12/h1-8,10H,9,11H2,(H,19,22)(H,23,24)/p-1