1-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]-4-methyl-2-propan-2-ylsulfanyl-7H-imidazo[4,5-b]pyrazine-5,6-dione

Systemtic Name: 1-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]-4-methyl-2-propan-2-ylsulfanyl-7H-imidazo[4,5-b]pyrazine-5,6-dione Openeye Name: 1-[3-(4-chlorophenoxy)-2-hydroxy-propyl]-2-isopropylsulfanyl-4-methyl-7H-imidazo[4,5-b]pyrazine-5,6-dione CAS Name: 1-[3-(4-chlorophenoxy)-2-hydroxypropyl]-4-methyl-2-(propan-2-ylthio)-7H-imidazo[4,5-b]pyrazine-5,6-dione IUPAC Name: 1-[3-(4-chlorophenoxy)-2-hydroxypropyl]-4-methyl-2-propan-2-ylsulfanyl-7H-imidazo[4,5-b]pyrazine-5,6-dione Traditional Name: 1-[3-(4-chlorophenoxy)-2-hydroxy-propyl]-2-(isopropylthio)-4-methyl-7H-imidazo[4,5-b]pyrazine-5,6-quinone Formula: C18H21ClN4O4S MolecularWeight: 424.90174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC2=C(N1CC(COC3=CC=C(C=C3)Cl)O)NC(=O)C(=O)N2C

Isomeric SMILES

CC(C)SC1=NC2=C(N1CC(COC3=CC=C(C=C3)Cl)O)NC(=O)C(=O)N2C

InChI

InChI=1S/C18H21ClN4O4S/c1-10(2)28-18-21-14-15(20-16(25)17(26)22(14)3)23(18)8-12(24)9-27-13-6-4-11(19)5-7-13/h4-7,10,12,24H,8-9H2,1-3H3,(H,20,25)