(4,7-dimethoxy-1H-indol-2-yl)-[4-(7H-purin-6-yl)piperazin-1-yl]methanone

Systemtic Name: (4,7-dimethoxy-1H-indol-2-yl)-[4-(7H-purin-6-yl)piperazin-1-yl]methanone Openeye Name: (4,7-dimethoxy-1H-indol-2-yl)-[4-(7H-purin-6-yl)piperazin-1-yl]methanone CAS Name: (4,7-dimethoxy-1H-indol-2-yl)-[4-(7H-purin-6-yl)-1-piperazinyl]methanone IUPAC Name: (4,7-dimethoxy-1H-indol-2-yl)-[4-(7H-purin-6-yl)piperazin-1-yl]methanone Traditional Name: (4,7-dimethoxy-1H-indol-2-yl)-[4-(7H-purin-6-yl)piperazino]methanone Formula: C20H21N7O3 MolecularWeight: 407.42584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=C(NC2=C(C=C1)OC)C(=O)N3CCN(CC3)C4=NC=NC5=C4NC=N5

Isomeric SMILES

COC1=C2C=C(NC2=C(C=C1)OC)C(=O)N3CCN(CC3)C4=NC=NC5=C4NC=N5

InChI

InChI=1S/C20H21N7O3/c1-29-14-3-4-15(30-2)16-12(14)9-13(25-16)20(28)27-7-5-26(6-8-27)19-17-18(22-10-21-17)23-11-24-19/h3-4,9-11,25H,5-8H2,1-2H3,(H,21,22,23,24)