3-butyl-8-(2,5-dimethylpyrrol-1-yl)-1H-benzo[g]pteridine-2,4-dione

Systemtic Name: 3-butyl-8-(2,5-dimethylpyrrol-1-yl)-1H-benzo[g]pteridine-2,4-dione Openeye Name: 3-butyl-8-(2,5-dimethylpyrrol-1-yl)-1H-benzo[g]pteridine-2,4-dione CAS Name: 3-butyl-8-(2,5-dimethyl-1-pyrrolyl)-1H-benzo[g]pteridine-2,4-dione IUPAC Name: 3-butyl-8-(2,5-dimethylpyrrol-1-yl)-1H-benzo[g]pteridine-2,4-dione Traditional Name: 3-butyl-8-(2,5-dimethylpyrrol-1-yl)-1H-benzo[g]pteridine-2,4-quinone Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=NC3=C(C=C(C=C3)N4C(=CC=C4C)C)N=C2NC1=O

Isomeric SMILES

CCCCN1C(=O)C2=NC3=C(C=C(C=C3)N4C(=CC=C4C)C)N=C2NC1=O

InChI

InChI=1S/C20H21N5O2/c1-4-5-10-24-19(26)17-18(23-20(24)27)22-16-11-14(8-9-15(16)21-17)25-12(2)6-7-13(25)3/h6-9,11H,4-5,10H2,1-3H3,(H,22,23,27)