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

Systemtic Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[2-(2-oxidanylideneindol-3-yl)hydrazinyl]purine-2,6-dione Openeye Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[2-(2-oxoindol-3-yl)hydrazino]purine-2,6-dione CAS Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[(2-oxo-3-indolyl)hydrazo]purine-2,6-dione IUPAC Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[2-(2-oxoindol-3-yl)hydrazinyl]purine-2,6-dione Traditional Name: 8-[N'-(2-ketoindol-3-yl)hydrazino]-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-xanthine Formula: C23H21N7O4 MolecularWeight: 459.45734

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NNC3=C4C=CC=CC4=NC3=O)CCC5=CC=C(C=C5)OC

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)NNC3=C4C=CC=CC4=NC3=O)CCC5=CC=C(C=C5)OC

InChI

InChI=1S/C23H21N7O4/c1-29-19-18(21(32)26-23(29)33)30(12-11-13-7-9-14(34-2)10-8-13)22(25-19)28-27-17-15-5-3-4-6-16(15)24-20(17)31/h3-10H,11-12H2,1-2H3,(H,25,28)(H,24,27,31)(H,26,32,33)