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2-[1,3-dimethyl-2,6-bis(oxidanylidene)-8-piperazin-1-yl-purin-7-yl]benzaldehyde

2-[1,3-dimethyl-2,6-bis(oxidanylidene)-8-piperazin-1-yl-purin-7-yl]benzaldehyde

Systemtic Name:2-[1,3-dimethyl-2,6-bis(oxidanylidene)-8-piperazin-1-yl-purin-7-yl]benzaldehyde
Openeye Name:2-(1,3-dimethyl-2,6-dioxo-8-piperazin-1-yl-purin-7-yl)benzaldehyde
CAS Name:2-[1,3-dimethyl-2,6-dioxo-8-(1-piperazinyl)-7-purinyl]benzaldehyde
IUPAC Name:2-(1,3-dimethyl-2,6-dioxo-8-piperazin-1-ylpurin-7-yl)benzaldehyde
Traditional Name:2-(2,6-diketo-1,3-dimethyl-8-piperazino-purin-7-yl)benzaldehyde
Formula: C18H20N6O3
MolecularWeight: 368.3898
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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCNCC3)C4=CC=CC=C4C=O


Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCNCC3)C4=CC=CC=C4C=O


InChI

InChI=1S/C18H20N6O3/c1-21-15-14(16(26)22(2)18(21)27)24(13-6-4-3-5-12(13)11-25)17(20-15)23-9-7-19-8-10-23/h3-6,11,19H,7-10H2,1-2H3


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