3-methyl-7-[(3-nitrophenyl)methylsulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 3-methyl-7-[(3-nitrophenyl)methylsulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Openeye Name: 3-methyl-7-[(3-nitrophenyl)methylsulfanylmethyl]thiazolo[3,2-a]pyrimidin-5-one CAS Name: 3-methyl-7-[[(3-nitrophenyl)methylthio]methyl]-5-thiazolo[3,2-a]pyrimidinone IUPAC Name: 3-methyl-7-[(3-nitrophenyl)methylsulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Traditional Name: 3-methyl-7-[[(3-nitrobenzyl)thio]methyl]thiazolo[3,2-a]pyrimidin-5-one Formula: C15H13N3O3S2 MolecularWeight: 347.41202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=NC(=CC(=O)N12)CSCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC2=NC(=CC(=O)N12)CSCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O3S2/c1-10-7-23-15-16-12(6-14(19)17(10)15)9-22-8-11-3-2-4-13(5-11)18(20)21/h2-7H,8-9H2,1H3