6-[(4-nitrophenyl)methylsulfanylmethyl]-1H-pyrimidine-2,4-dione

Systemtic Name: 6-[(4-nitrophenyl)methylsulfanylmethyl]-1H-pyrimidine-2,4-dione Openeye Name: 6-[(4-nitrophenyl)methylsulfanylmethyl]-1H-pyrimidine-2,4-dione CAS Name: 6-[[(4-nitrophenyl)methylthio]methyl]-1H-pyrimidine-2,4-dione IUPAC Name: 6-[(4-nitrophenyl)methylsulfanylmethyl]-1H-pyrimidine-2,4-dione Traditional Name: 6-[[(4-nitrobenzyl)thio]methyl]uracil Formula: C12H11N3O4S MolecularWeight: 293.29844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCC2=CC(=O)NC(=O)N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSCC2=CC(=O)NC(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O4S/c16-11-5-9(13-12(17)14-11)7-20-6-8-1-3-10(4-2-8)15(18)19/h1-5H,6-7H2,(H2,13,14,16,17)