4-azanyl-N-[[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]methyl]benzamide

Systemtic Name: 4-azanyl-N-[[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]methyl]benzamide Openeye Name: 4-amino-N-[(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)methyl]benzamide CAS Name: 4-amino-N-[(1,3,7-trimethyl-2,6-dioxo-8-purinyl)methyl]benzamide IUPAC Name: 4-amino-N-[(1,3,7-trimethyl-2,6-dioxopurin-8-yl)methyl]benzamide Traditional Name: 4-amino-N-[(2,6-diketo-1,3,7-trimethyl-purin-8-yl)methyl]benzamide Formula: C16H18N6O3 MolecularWeight: 342.35252

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CNC(=O)C3=CC=C(C=C3)N

Isomeric SMILES

CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CNC(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C16H18N6O3/c1-20-11(8-18-14(23)9-4-6-10(17)7-5-9)19-13-12(20)15(24)22(3)16(25)21(13)2/h4-7H,8,17H2,1-3H3,(H,18,23)