4-methyl-8-(1-methyl-2-oxidanylidene-indol-3-ylidene)-6-(phenylmethyl)purino[7,8-a]imidazole-1,3,7-trione

Systemtic Name: 4-methyl-8-(1-methyl-2-oxidanylidene-indol-3-ylidene)-6-(phenylmethyl)purino[7,8-a]imidazole-1,3,7-trione Openeye Name: 6-benzyl-4-methyl-8-(1-methyl-2-oxo-indolin-3-ylidene)purino[7,8-a]imidazole-1,3,7-trione CAS Name: 4-methyl-8-(1-methyl-2-oxo-3-indolylidene)-6-(phenylmethyl)purino[7,8-a]imidazole-1,3,7-trione IUPAC Name: 6-benzyl-4-methyl-8-(1-methyl-2-oxoindol-3-ylidene)purino[7,8-a]imidazole-1,3,7-trione Traditional Name: 6-benzyl-8-(2-keto-1-methyl-indolin-3-ylidene)-4-methyl-purin[7,8-a]imidazole-1,3,7-trione Formula: C24H18N6O4 MolecularWeight: 454.43752

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C3C(=O)N(C4=NC5=C(N34)C(=O)NC(=O)N5C)CC6=CC=CC=C6)C1=O

Isomeric SMILES

CN1C2=CC=CC=C2C(=C3C(=O)N(C4=NC5=C(N34)C(=O)NC(=O)N5C)CC6=CC=CC=C6)C1=O

InChI

InChI=1S/C24H18N6O4/c1-27-15-11-7-6-10-14(15)16(21(27)32)17-22(33)29(12-13-8-4-3-5-9-13)23-25-19-18(30(17)23)20(31)26-24(34)28(19)2/h3-11H,12H2,1-2H3,(H,26,31,34)