N-(3-imidazol-1-ylpropyl)-3-(phenylsulfonylmethyl)-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-3-(phenylsulfonylmethyl)-1,2,4-oxadiazole-5-carboxamide Openeye Name: 3-(benzenesulfonylmethyl)-N-(3-imidazol-1-ylpropyl)-1,2,4-oxadiazole-5-carboxamide CAS Name: 3-(benzenesulfonylmethyl)-N-[3-(1-imidazolyl)propyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-(3-imidazol-1-ylpropyl)-1,2,4-oxadiazole-5-carboxamide Traditional Name: 3-(besylmethyl)-N-(3-imidazol-1-ylpropyl)-1,2,4-oxadiazole-5-carboxamide Formula: C16H17N5O4S MolecularWeight: 375.40228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC2=NOC(=N2)C(=O)NCCCN3C=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC2=NOC(=N2)C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C16H17N5O4S/c22-15(18-7-4-9-21-10-8-17-12-21)16-19-14(20-25-16)11-26(23,24)13-5-2-1-3-6-13/h1-3,5-6,8,10,12H,4,7,9,11H2,(H,18,22)