2-[(3-chlorophenyl)methyl]-1-oxidanyl-7-phenylsulfanyl-pyrido[1,2-a]pyrazine-8,9-dione

Systemtic Name: 2-[(3-chlorophenyl)methyl]-1-oxidanyl-7-phenylsulfanyl-pyrido[1,2-a]pyrazine-8,9-dione Openeye Name: 2-[(3-chlorophenyl)methyl]-1-hydroxy-7-phenylsulfanyl-pyrido[1,2-a]pyrazine-8,9-dione CAS Name: 2-[(3-chlorophenyl)methyl]-1-hydroxy-7-(phenylthio)pyrido[1,2-a]pyrazine-8,9-dione IUPAC Name: 2-[(3-chlorophenyl)methyl]-1-hydroxy-7-phenylsulfanylpyrido[1,2-a]pyrazine-8,9-dione Traditional Name: 2-(3-chlorobenzyl)-1-hydroxy-7-(phenylthio)pyrido[1,2-a]pyrazine-8,9-quinone Formula: C21H15ClN2O3S MolecularWeight: 410.8734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CN3C=CN(C(=C3C(=O)C2=O)O)CC4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)SC2=CN3C=CN(C(=C3C(=O)C2=O)O)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H15ClN2O3S/c22-15-6-4-5-14(11-15)12-24-10-9-23-13-17(28-16-7-2-1-3-8-16)19(25)20(26)18(23)21(24)27/h1-11,13,27H,12H2