8-[2-[5-bromanyl-2-oxidanylidene-1-(phenylmethyl)indol-3-ylidene]hydrazinyl]-7-ethyl-3-methyl-1-(phenylmethyl)purine-2,6-dione

Systemtic Name: 8-[2-[5-bromanyl-2-oxidanylidene-1-(phenylmethyl)indol-3-ylidene]hydrazinyl]-7-ethyl-3-methyl-1-(phenylmethyl)purine-2,6-dione Openeye Name: 1-benzyl-8-[2-(1-benzyl-5-bromo-2-oxo-indolin-3-ylidene)hydrazino]-7-ethyl-3-methyl-purine-2,6-dione CAS Name: 8-[2-[5-bromo-2-oxo-1-(phenylmethyl)-3-indolylidene]hydrazinyl]-7-ethyl-3-methyl-1-(phenylmethyl)purine-2,6-dione IUPAC Name: 1-benzyl-8-[2-(1-benzyl-5-bromo-2-oxoindol-3-ylidene)hydrazinyl]-7-ethyl-3-methylpurine-2,6-dione Traditional Name: 1-benzyl-8-[N'-(1-benzyl-5-bromo-2-keto-indolin-3-ylidene)hydrazino]-7-ethyl-3-methyl-xanthine Formula: C30H26BrN7O3 MolecularWeight: 612.47654

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=C1NN=C3C4=C(C=CC(=C4)Br)N(C3=O)CC5=CC=CC=C5)N(C(=O)N(C2=O)CC6=CC=CC=C6)C

Isomeric SMILES

CCN1C2=C(N=C1NN=C3C4=C(C=CC(=C4)Br)N(C3=O)CC5=CC=CC=C5)N(C(=O)N(C2=O)CC6=CC=CC=C6)C

InChI

InChI=1S/C30H26BrN7O3/c1-3-36-25-26(35(2)30(41)38(28(25)40)18-20-12-8-5-9-13-20)32-29(36)34-33-24-22-16-21(31)14-15-23(22)37(27(24)39)17-19-10-6-4-7-11-19/h4-16H,3,17-18H2,1-2H3,(H,32,34)