6-phenacyl-3-(phenylmethyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 6-phenacyl-3-(phenylmethyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-one Openeye Name: 3-benzyl-6-phenacyl-triazolo[4,5-d]pyrimidin-7-one CAS Name: 6-phenacyl-3-(phenylmethyl)-7-triazolo[4,5-d]pyrimidinone IUPAC Name: 3-benzyl-6-phenacyltriazolo[4,5-d]pyrimidin-7-one Traditional Name: 3-benzyl-6-phenacyl-triazolo[4,5-d]pyrimidin-7-one Formula: C19H15N5O2 MolecularWeight: 345.3547

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=O)N(C=N3)CC(=O)C4=CC=CC=C4)N=N2

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=O)N(C=N3)CC(=O)C4=CC=CC=C4)N=N2

InChI

InChI=1S/C19H15N5O2/c25-16(15-9-5-2-6-10-15)12-23-13-20-18-17(19(23)26)21-22-24(18)11-14-7-3-1-4-8-14/h1-10,13H,11-12H2