5-iodanyl-3-methyl-1-(2-methylpropyl)-6-(naphthalen-1-ylmethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 5-iodanyl-3-methyl-1-(2-methylpropyl)-6-(naphthalen-1-ylmethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-iodo-1-isobutyl-3-methyl-6-(1-naphthylmethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-iodo-3-methyl-1-(2-methylpropyl)-6-(1-naphthalenylmethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-iodo-3-methyl-1-(2-methylpropyl)-6-(naphthalen-1-ylmethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-iodo-1-isobutyl-3-methyl-6-(1-naphthylmethyl)pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C22H22IN3O2 MolecularWeight: 487.33345

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CN(C(=C2C(=O)N(C1=O)C)I)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)CN1C2=CN(C(=C2C(=O)N(C1=O)C)I)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H22IN3O2/c1-14(2)11-26-18-13-25(20(23)19(18)21(27)24(3)22(26)28)12-16-9-6-8-15-7-4-5-10-17(15)16/h4-10,13-14H,11-12H2,1-3H3