2-phenylazanyl-8-prop-2-enyl-3,7-dihydropurin-6-one

Systemtic Name: 2-phenylazanyl-8-prop-2-enyl-3,7-dihydropurin-6-one Openeye Name: 8-allyl-2-anilino-3,7-dihydropurin-6-one CAS Name: 2-anilino-8-prop-2-enyl-3,7-dihydropurin-6-one IUPAC Name: 2-anilino-8-prop-2-enyl-3,7-dihydropurin-6-one Traditional Name: 8-allyl-2-anilino-3,7-dihydropurin-6-one Formula: C14H13N5O MolecularWeight: 267.28592

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=NC2=C(N1)C(=O)N=C(N2)NC3=CC=CC=C3

Isomeric SMILES

C=CCC1=NC2=C(N1)C(=O)N=C(N2)NC3=CC=CC=C3

InChI

InChI=1S/C14H13N5O/c1-2-6-10-16-11-12(17-10)18-14(19-13(11)20)15-9-7-4-3-5-8-9/h2-5,7-8H,1,6H2,(H3,15,16,17,18,19,20)