10-ethyl-3-[8-(triphenylmethyl)sulfanyloctyl]benzo[g]pteridine-2,4-dione

Systemtic Name: 10-ethyl-3-[8-(triphenylmethyl)sulfanyloctyl]benzo[g]pteridine-2,4-dione Openeye Name: 10-ethyl-3-(8-tritylsulfanyloctyl)benzo[g]pteridine-2,4-dione CAS Name: 10-ethyl-3-[8-[(triphenylmethyl)thio]octyl]benzo[g]pteridine-2,4-dione IUPAC Name: 10-ethyl-3-(8-tritylsulfanyloctyl)benzo[g]pteridine-2,4-dione Traditional Name: 10-ethyl-3-[8-(tritylthio)octyl]benzo[g]pteridine-2,4-quinone Formula: C39H40N4O2S MolecularWeight: 628.8255

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C3C1=NC(=O)N(C3=O)CCCCCCCCSC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCN1C2=CC=CC=C2N=C3C1=NC(=O)N(C3=O)CCCCCCCCSC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C39H40N4O2S/c1-2-42-34-27-17-16-26-33(34)40-35-36(42)41-38(45)43(37(35)44)28-18-5-3-4-6-19-29-46-39(30-20-10-7-11-21-30,31-22-12-8-13-23-31)32-24-14-9-15-25-32/h7-17,20-27H,2-6,18-19,28-29H2,1H3