1,3-dimethyl-8-phenanthridin-6-ylsulfanyl-7H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-phenanthridin-6-ylsulfanyl-7H-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-phenanthridin-6-ylsulfanyl-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-(6-phenanthridinylthio)-7H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-phenanthridin-6-ylsulfanyl-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-(phenanthridin-6-ylthio)-7H-purine-2,6-quinone Formula: C20H15N5O2S MolecularWeight: 389.4304

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)SC3=NC4=CC=CC=C4C5=CC=CC=C53

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)SC3=NC4=CC=CC=C4C5=CC=CC=C53

InChI

InChI=1S/C20H15N5O2S/c1-24-16-15(18(26)25(2)20(24)27)22-19(23-16)28-17-13-9-4-3-7-11(13)12-8-5-6-10-14(12)21-17/h3-10H,1-2H3,(H,22,23)