6-azanyl-2-[(2-chloranyl-4-nitro-phenyl)methylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[(2-chloranyl-4-nitro-phenyl)methylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[(2-chloro-4-nitro-phenyl)methylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-amino-2-[(2-chloro-4-nitrophenyl)methylthio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[(2-chloro-4-nitrophenyl)methylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[(2-chloro-4-nitro-benzyl)thio]-1H-pyrimidin-4-one Formula: C11H9ClN4O3S MolecularWeight: 312.73216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)CSC2=NC(=O)C=C(N2)N

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)CSC2=NC(=O)C=C(N2)N

InChI

InChI=1S/C11H9ClN4O3S/c12-8-3-7(16(18)19)2-1-6(8)5-20-11-14-9(13)4-10(17)15-11/h1-4H,5H2,(H3,13,14,15,17)