3-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 3-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoylamino]-N,N-diethyl-benzamide Openeye Name: 3-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetyl]amino]-N,N-diethyl-benzamide Formula: C20H24N6O4 MolecularWeight: 412.44236

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C20H24N6O4/c1-5-25(6-2)18(28)13-8-7-9-14(10-13)22-15(27)11-26-12-21-17-16(26)19(29)24(4)20(30)23(17)3/h7-10,12H,5-6,11H2,1-4H3,(H,22,27)