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1,3-dimethyl-6-oct-1-ynyl-7-(2-phenylethynyl)pteridine-2,4-dione

1,3-dimethyl-6-oct-1-ynyl-7-(2-phenylethynyl)pteridine-2,4-dione

Systemtic Name:1,3-dimethyl-6-oct-1-ynyl-7-(2-phenylethynyl)pteridine-2,4-dione
Openeye Name:1,3-dimethyl-6-oct-1-ynyl-7-(2-phenylethynyl)pteridine-2,4-dione
CAS Name:1,3-dimethyl-6-oct-1-ynyl-7-(2-phenylethynyl)pteridine-2,4-dione
IUPAC Name:1,3-dimethyl-6-oct-1-ynyl-7-(2-phenylethynyl)pteridine-2,4-dione
Traditional Name:1,3-dimethyl-6-oct-1-ynyl-7-(2-phenylethynyl)pteridine-2,4-quinone
Formula: C24H24N4O2
MolecularWeight: 400.47296
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=C(N=C2C(=N1)C(=O)N(C(=O)N2C)C)C#CC3=CC=CC=C3


Isomeric SMILES

CCCCCCC#CC1=C(N=C2C(=N1)C(=O)N(C(=O)N2C)C)C#CC3=CC=CC=C3


InChI

InChI=1S/C24H24N4O2/c1-4-5-6-7-8-12-15-19-20(17-16-18-13-10-9-11-14-18)26-22-21(25-19)23(29)28(3)24(30)27(22)2/h9-11,13-14H,4-8H2,1-3H3


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