9-(4-methylphenyl)-8-oxidanylidene-2-[(Z)-prop-1-enyl]-7H-purine-6-carboxamide

Systemtic Name: 9-(4-methylphenyl)-8-oxidanylidene-2-[(Z)-prop-1-enyl]-7H-purine-6-carboxamide Openeye Name: 8-oxo-2-[(Z)-prop-1-enyl]-9-(p-tolyl)-7H-purine-6-carboxamide CAS Name: 9-(4-methylphenyl)-8-oxo-2-[(Z)-prop-1-enyl]-7H-purine-6-carboxamide IUPAC Name: 9-(4-methylphenyl)-8-oxo-2-[(Z)-prop-1-enyl]-7H-purine-6-carboxamide Traditional Name: 8-keto-2-[(Z)-prop-1-enyl]-9-(p-tolyl)-7H-purine-6-carboxamide Formula: C16H15N5O2 MolecularWeight: 309.3226

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=NC(=C2C(=N1)N(C(=O)N2)C3=CC=C(C=C3)C)C(=O)N

Isomeric SMILES

C/C=C\C1=NC(=C2C(=N1)N(C(=O)N2)C3=CC=C(C=C3)C)C(=O)N

InChI

InChI=1S/C16H15N5O2/c1-3-4-11-18-12(14(17)22)13-15(19-11)21(16(23)20-13)10-7-5-9(2)6-8-10/h3-8H,1-2H3,(H2,17,22)(H,20,23)/b4-3-