N-[(4-dimethylaminophenyl)methyl]-2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxo-7-purinyl)acetamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-[4-(dimethylamino)benzyl]acetamide Formula: C18H22N6O3 MolecularWeight: 370.40568

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NCC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NCC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C18H22N6O3/c1-21(2)13-7-5-12(6-8-13)9-19-14(25)10-24-11-20-16-15(24)17(26)23(4)18(27)22(16)3/h5-8,11H,9-10H2,1-4H3,(H,19,25)