3-methyl-7-[(4-methylphenyl)methyl]-8-[2-(2-oxidanylideneindol-3-yl)hydrazinyl]purine-2,6-dione

Systemtic Name: 3-methyl-7-[(4-methylphenyl)methyl]-8-[2-(2-oxidanylideneindol-3-yl)hydrazinyl]purine-2,6-dione Openeye Name: 3-methyl-8-[2-(2-oxoindol-3-yl)hydrazino]-7-(p-tolylmethyl)purine-2,6-dione CAS Name: 3-methyl-7-[(4-methylphenyl)methyl]-8-[(2-oxo-3-indolyl)hydrazo]purine-2,6-dione IUPAC Name: 3-methyl-7-[(4-methylphenyl)methyl]-8-[2-(2-oxoindol-3-yl)hydrazinyl]purine-2,6-dione Traditional Name: 8-[N'-(2-ketoindol-3-yl)hydrazino]-3-methyl-7-(4-methylbenzyl)xanthine Formula: C22H19N7O3 MolecularWeight: 429.43136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=C(N=C2NNC4=C5C=CC=CC5=NC4=O)N(C(=O)NC3=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=C(N=C2NNC4=C5C=CC=CC5=NC4=O)N(C(=O)NC3=O)C

InChI

InChI=1S/C22H19N7O3/c1-12-7-9-13(10-8-12)11-29-17-18(28(2)22(32)25-20(17)31)24-21(29)27-26-16-14-5-3-4-6-15(14)23-19(16)30/h3-10H,11H2,1-2H3,(H,24,27)(H,23,26,30)(H,25,31,32)