4-chloranyl-2-(phenylmethylsulfanyl)-8H-pyrimido[5,4-b][1,4]thiazin-7-one

Systemtic Name: 4-chloranyl-2-(phenylmethylsulfanyl)-8H-pyrimido[5,4-b][1,4]thiazin-7-one Openeye Name: 2-benzylsulfanyl-4-chloro-8H-pyrimido[5,4-b][1,4]thiazin-7-one CAS Name: 4-chloro-2-(phenylmethylthio)-8H-pyrimido[5,4-b][1,4]thiazin-7-one IUPAC Name: 2-benzylsulfanyl-4-chloro-8H-pyrimido[5,4-b][1,4]thiazin-7-one Traditional Name: 2-(benzylthio)-4-chloro-8H-pyrimido[5,4-b][1,4]thiazin-7-one Formula: C13H10ClN3OS2 MolecularWeight: 323.821

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(S1)C(=NC(=N2)SCC3=CC=CC=C3)Cl

Isomeric SMILES

C1C(=O)NC2=C(S1)C(=NC(=N2)SCC3=CC=CC=C3)Cl

InChI

InChI=1S/C13H10ClN3OS2/c14-11-10-12(15-9(18)7-19-10)17-13(16-11)20-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,15,16,17,18)