N-[2,4-bis(oxidanylidene)-3-phenethyl-1H-benzo[g]pteridin-8-yl]heptanamide

Systemtic Name: N-[2,4-bis(oxidanylidene)-3-phenethyl-1H-benzo[g]pteridin-8-yl]heptanamide Openeye Name: N-(2,4-dioxo-3-phenethyl-1H-benzo[g]pteridin-8-yl)heptanamide CAS Name: N-(2,4-dioxo-3-phenethyl-1H-benzo[g]pteridin-8-yl)heptanamide IUPAC Name: N-(2,4-dioxo-3-phenethyl-1H-benzo[g]pteridin-8-yl)heptanamide Traditional Name: N-(2,4-diketo-3-phenethyl-1H-benzo[g]pteridin-8-yl)enanthamide Formula: C25H27N5O3 MolecularWeight: 445.51358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1=CC2=C(C=C1)N=C3C(=N2)NC(=O)N(C3=O)CCC4=CC=CC=C4

Isomeric SMILES

CCCCCCC(=O)NC1=CC2=C(C=C1)N=C3C(=N2)NC(=O)N(C3=O)CCC4=CC=CC=C4

InChI

InChI=1S/C25H27N5O3/c1-2-3-4-8-11-21(31)26-18-12-13-19-20(16-18)28-23-22(27-19)24(32)30(25(33)29-23)15-14-17-9-6-5-7-10-17/h5-7,9-10,12-13,16H,2-4,8,11,14-15H2,1H3,(H,26,31)(H,28,29,33)