3-methoxy-N-(5-oxidanylidene-2-phenethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide

Systemtic Name: 3-methoxy-N-(5-oxidanylidene-2-phenethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide Openeye Name: 3-methoxy-N-(5-oxo-2-phenethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide CAS Name: 3-methoxy-N-(5-oxo-2-phenethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide IUPAC Name: 3-methoxy-N-(5-oxo-2-phenethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide Traditional Name: N-(5-keto-2-phenethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-3-methoxy-benzamide Formula: C21H19N5O3 MolecularWeight: 389.40726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=CC(=O)N=C3N2NC(=N3)CCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=CC(=O)N=C3N2NC(=N3)CCC4=CC=CC=C4

InChI

InChI=1S/C21H19N5O3/c1-29-16-9-5-8-15(12-16)20(28)23-18-13-19(27)24-21-22-17(25-26(18)21)11-10-14-6-3-2-4-7-14/h2-9,12-13H,10-11H2,1H3,(H,23,28)(H,22,24,25,27)