4-(3-ethyl-1,2,4-oxadiazol-5-yl)-4-oxidanylidene-3-[3-(phenylmethyl)sulfonylpropanoylamino]butanamide

Systemtic Name: 4-(3-ethyl-1,2,4-oxadiazol-5-yl)-4-oxidanylidene-3-[3-(phenylmethyl)sulfonylpropanoylamino]butanamide Openeye Name: 3-(3-benzylsulfonylpropanoylamino)-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-4-oxo-butanamide CAS Name: 4-(3-ethyl-1,2,4-oxadiazol-5-yl)-4-oxo-3-[[1-oxo-3-(phenylmethyl)sulfonylpropyl]amino]butanamide IUPAC Name: 3-(3-benzylsulfonylpropanoylamino)-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-4-oxobutanamide Traditional Name: 3-(3-benzylsulfonylpropanoylamino)-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-4-keto-butyramide Formula: C18H22N4O6S MolecularWeight: 422.45548

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=N1)C(=O)C(CC(=O)N)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CCC1=NOC(=N1)C(=O)C(CC(=O)N)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C18H22N4O6S/c1-2-15-21-18(28-22-15)17(25)13(10-14(19)23)20-16(24)8-9-29(26,27)11-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3,(H2,19,23)(H,20,24)