N-[azanyl-[9-(4-methoxyphenyl)-2-oxidanylidene-1H-purin-6-yl]methylidene]benzamide

Systemtic Name: N-[azanyl-[9-(4-methoxyphenyl)-2-oxidanylidene-1H-purin-6-yl]methylidene]benzamide Openeye Name: N-[amino-[9-(4-methoxyphenyl)-2-oxo-1H-purin-6-yl]methylene]benzamide CAS Name: N-[amino-[9-(4-methoxyphenyl)-2-oxo-1H-purin-6-yl]methylidene]benzamide IUPAC Name: N-[amino-[9-(4-methoxyphenyl)-2-oxo-1H-purin-6-yl]methylidene]benzamide Traditional Name: N-[amino-[2-keto-9-(4-methoxyphenyl)-1H-purin-6-yl]methylene]benzamide Formula: C20H16N6O3 MolecularWeight: 388.37944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=NC3=C(NC(=O)N=C32)C(=NC(=O)C4=CC=CC=C4)N

Isomeric SMILES

COC1=CC=C(C=C1)N2C=NC3=C(NC(=O)N=C32)C(=NC(=O)C4=CC=CC=C4)N

InChI

InChI=1S/C20H16N6O3/c1-29-14-9-7-13(8-10-14)26-11-22-16-15(23-20(28)25-18(16)26)17(21)24-19(27)12-5-3-2-4-6-12/h2-11H,1H3,(H2,21,24,27)(H,23,25,28)