7-[(4-ethanoyl-2-nitro-phenyl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 7-[(4-ethanoyl-2-nitro-phenyl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-[(4-acetyl-2-nitro-phenyl)sulfanylmethyl]thiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-[[(4-acetyl-2-nitrophenyl)thio]methyl]-5-thiazolo[3,2-a]pyrimidinone IUPAC Name: 7-[(4-acetyl-2-nitrophenyl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Traditional Name: 7-[[(4-acetyl-2-nitro-phenyl)thio]methyl]thiazolo[3,2-a]pyrimidin-5-one Formula: C15H11N3O4S2 MolecularWeight: 361.39554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)SCC2=CC(=O)N3C=CSC3=N2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)SCC2=CC(=O)N3C=CSC3=N2)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O4S2/c1-9(19)10-2-3-13(12(6-10)18(21)22)24-8-11-7-14(20)17-4-5-23-15(17)16-11/h2-7H,8H2,1H3