9-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-3-methyl-7-(3-methylbut-2-enyl)-8-piperazin-1-yl-8H-purine-2,6-dione

Systemtic Name: 9-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-3-methyl-7-(3-methylbut-2-enyl)-8-piperazin-1-yl-8H-purine-2,6-dione Openeye Name: 9-[2-(3-methoxyphenyl)-2-oxo-ethyl]-3-methyl-7-(3-methylbut-2-enyl)-8-piperazin-1-yl-8H-purine-2,6-dione CAS Name: 9-[2-(3-methoxyphenyl)-2-oxoethyl]-3-methyl-7-(3-methylbut-2-enyl)-8-(1-piperazinyl)-8H-purine-2,6-dione IUPAC Name: 9-[2-(3-methoxyphenyl)-2-oxoethyl]-3-methyl-7-(3-methylbut-2-enyl)-8-piperazin-1-yl-8H-purine-2,6-dione Traditional Name: 9-[2-keto-2-(3-methoxyphenyl)ethyl]-3-methyl-7-(3-methylbut-2-enyl)-8-piperazino-8H-purine-2,6-quinone Formula: C24H32N6O4 MolecularWeight: 468.54868

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C(N(C2=C1C(=O)NC(=O)N2C)CC(=O)C3=CC(=CC=C3)OC)N4CCNCC4)C

Isomeric SMILES

CC(=CCN1C(N(C2=C1C(=O)NC(=O)N2C)CC(=O)C3=CC(=CC=C3)OC)N4CCNCC4)C

InChI

InChI=1S/C24H32N6O4/c1-16(2)8-11-29-20-21(32)26-23(33)27(3)22(20)30(24(29)28-12-9-25-10-13-28)15-19(31)17-6-5-7-18(14-17)34-4/h5-8,14,24-25H,9-13,15H2,1-4H3,(H,26,32,33)