10-phenyl-3-(5-sulfanylpentyl)benzo[g]pteridine-2,4-dione

Systemtic Name: 10-phenyl-3-(5-sulfanylpentyl)benzo[g]pteridine-2,4-dione Openeye Name: 10-phenyl-3-(5-sulfanylpentyl)benzo[g]pteridine-2,4-dione CAS Name: 3-(5-mercaptopentyl)-10-phenylbenzo[g]pteridine-2,4-dione IUPAC Name: 10-phenyl-3-(5-sulfanylpentyl)benzo[g]pteridine-2,4-dione Traditional Name: 3-(5-mercaptopentyl)-10-phenyl-benzo[g]pteridine-2,4-quinone Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=CC=CC=C3N=C4C2=NC(=O)N(C4=O)CCCCCS

Isomeric SMILES

C1=CC=C(C=C1)N2C3=CC=CC=C3N=C4C2=NC(=O)N(C4=O)CCCCCS

InChI

InChI=1S/C21H20N4O2S/c26-20-18-19(23-21(27)24(20)13-7-2-8-14-28)25(15-9-3-1-4-10-15)17-12-6-5-11-16(17)22-18/h1,3-6,9-12,28H,2,7-8,13-14H2