(5-methoxy-1,2-dimethyl-indol-3-yl)-[4-(7H-purin-6-yl)piperazin-1-yl]methanone

Systemtic Name: (5-methoxy-1,2-dimethyl-indol-3-yl)-[4-(7H-purin-6-yl)piperazin-1-yl]methanone Openeye Name: (5-methoxy-1,2-dimethyl-indol-3-yl)-[4-(7H-purin-6-yl)piperazin-1-yl]methanone CAS Name: (5-methoxy-1,2-dimethyl-3-indolyl)-[4-(7H-purin-6-yl)-1-piperazinyl]methanone IUPAC Name: (5-methoxy-1,2-dimethylindol-3-yl)-[4-(7H-purin-6-yl)piperazin-1-yl]methanone Traditional Name: (5-methoxy-1,2-dimethyl-indol-3-yl)-[4-(7H-purin-6-yl)piperazino]methanone Formula: C21H23N7O2 MolecularWeight: 405.45302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C)C=CC(=C2)OC)C(=O)N3CCN(CC3)C4=NC=NC5=C4NC=N5

Isomeric SMILES

CC1=C(C2=C(N1C)C=CC(=C2)OC)C(=O)N3CCN(CC3)C4=NC=NC5=C4NC=N5

InChI

InChI=1S/C21H23N7O2/c1-13-17(15-10-14(30-3)4-5-16(15)26(13)2)21(29)28-8-6-27(7-9-28)20-18-19(23-11-22-18)24-12-25-20/h4-5,10-12H,6-9H2,1-3H3,(H,22,23,24,25)