2-phenyl-N-[[3-(1-propylbenzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]ethanamide

Systemtic Name: 2-phenyl-N-[[3-(1-propylbenzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]ethanamide Openeye Name: 2-phenyl-N-[[3-(1-propylbenzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]acetamide CAS Name: 2-phenyl-N-[[3-(1-propyl-5-benzotriazolyl)-1,2,4-oxadiazol-5-yl]methyl]acetamide IUPAC Name: 2-phenyl-N-[[3-(1-propylbenzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]acetamide Traditional Name: 2-phenyl-N-[[3-(1-propylbenzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]acetamide Formula: C20H20N6O2 MolecularWeight: 376.4118

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)C3=NOC(=N3)CNC(=O)CC4=CC=CC=C4)N=N1

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)C3=NOC(=N3)CNC(=O)CC4=CC=CC=C4)N=N1

InChI

InChI=1S/C20H20N6O2/c1-2-10-26-17-9-8-15(12-16(17)23-25-26)20-22-19(28-24-20)13-21-18(27)11-14-6-4-3-5-7-14/h3-9,12H,2,10-11,13H2,1H3,(H,21,27)