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

Systemtic Name: 3-(phenylmethyl)-6-prop-2-enyl-[1,2,3]triazolo[4,5-d]pyrimidin-7-one Openeye Name: 6-allyl-3-benzyl-triazolo[4,5-d]pyrimidin-7-one CAS Name: 3-(phenylmethyl)-6-prop-2-enyl-7-triazolo[4,5-d]pyrimidinone IUPAC Name: 3-benzyl-6-prop-2-enyltriazolo[4,5-d]pyrimidin-7-one Traditional Name: 6-allyl-3-benzyl-triazolo[4,5-d]pyrimidin-7-one Formula: C14H13N5O MolecularWeight: 267.28592

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=NC2=C(C1=O)N=NN2CC3=CC=CC=C3

Isomeric SMILES

C=CCN1C=NC2=C(C1=O)N=NN2CC3=CC=CC=C3

InChI

InChI=1S/C14H13N5O/c1-2-8-18-10-15-13-12(14(18)20)16-17-19(13)9-11-6-4-3-5-7-11/h2-7,10H,1,8-9H2