3-(6-aminopurin-9-yl)-4-(1H-indol-3-yl)-1-methyl-pyrrole-2,5-dione

Systemtic Name: 3-(6-aminopurin-9-yl)-4-(1H-indol-3-yl)-1-methyl-pyrrole-2,5-dione Openeye Name: 3-(6-aminopurin-9-yl)-4-(1H-indol-3-yl)-1-methyl-pyrrole-2,5-dione CAS Name: 3-(6-aminopurin-9-yl)-4-(1H-indol-3-yl)-1-methylpyrrole-2,5-dione IUPAC Name: 3-(6-aminopurin-9-yl)-4-(1H-indol-3-yl)-1-methylpyrrole-2,5-dione Traditional Name: 3-adenin-9-yl-4-(1H-indol-3-yl)-1-methyl-3-pyrroline-2,5-quinone Formula: C18H13N7O2 MolecularWeight: 359.34152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(C1=O)N2C=NC3=C2N=CN=C3N)C4=CNC5=CC=CC=C54

Isomeric SMILES

CN1C(=O)C(=C(C1=O)N2C=NC3=C2N=CN=C3N)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C18H13N7O2/c1-24-17(26)12(10-6-20-11-5-3-2-4-9(10)11)14(18(24)27)25-8-23-13-15(19)21-7-22-16(13)25/h2-8,20H,1H3,(H2,19,21,22)