8-[(2Z)-2-[(4-bromophenyl)methylidene]hydrazinyl]-3-methyl-7-(phenylmethyl)purine-2,6-dione

Systemtic Name: 8-[(2Z)-2-[(4-bromophenyl)methylidene]hydrazinyl]-3-methyl-7-(phenylmethyl)purine-2,6-dione Openeye Name: 7-benzyl-8-[(2Z)-2-[(4-bromophenyl)methylene]hydrazino]-3-methyl-purine-2,6-dione CAS Name: 8-[(2Z)-2-[(4-bromophenyl)methylidene]hydrazinyl]-3-methyl-7-(phenylmethyl)purine-2,6-dione IUPAC Name: 7-benzyl-8-[(2Z)-2-[(4-bromophenyl)methylidene]hydrazinyl]-3-methylpurine-2,6-dione Traditional Name: 7-benzyl-8-[(N'Z)-N'-(4-bromobenzylidene)hydrazino]-3-methyl-xanthine Formula: C20H17BrN6O2 MolecularWeight: 453.29198

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC3=CC=C(C=C3)Br)CC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)N/N=C\C3=CC=C(C=C3)Br)CC4=CC=CC=C4

InChI

InChI=1S/C20H17BrN6O2/c1-26-17-16(18(28)24-20(26)29)27(12-14-5-3-2-4-6-14)19(23-17)25-22-11-13-7-9-15(21)10-8-13/h2-11H,12H2,1H3,(H,23,25)(H,24,28,29)/b22-11-