3-(7-oxidanylidene-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl)-4-propoxy-benzamide

Systemtic Name: 3-(7-oxidanylidene-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl)-4-propoxy-benzamide Openeye Name: 3-(7-oxotriazolo[4,5-d]pyrimidin-5-yl)-4-propoxy-benzamide CAS Name: 3-(7-oxo-5-triazolo[4,5-d]pyrimidinyl)-4-propoxybenzamide IUPAC Name: 3-(7-oxotriazolo[4,5-d]pyrimidin-5-yl)-4-propoxybenzamide Traditional Name: 3-(7-ketotriazolo[4,5-d]pyrimidin-5-yl)-4-propoxy-benzamide Formula: C14H12N6O3 MolecularWeight: 312.28348

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)N)C2=NC(=O)C3=NN=NC3=N2

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)N)C2=NC(=O)C3=NN=NC3=N2

InChI

InChI=1S/C14H12N6O3/c1-2-5-23-9-4-3-7(11(15)21)6-8(9)12-16-13-10(14(22)17-12)18-20-19-13/h3-4,6H,2,5H2,1H3,(H2,15,21)