6-chloranyl-5-nitro-2-(phenylmethylsulfanyl)pyrimidin-4-amine

Systemtic Name: 6-chloranyl-5-nitro-2-(phenylmethylsulfanyl)pyrimidin-4-amine Openeye Name: 2-benzylsulfanyl-6-chloro-5-nitro-pyrimidin-4-amine CAS Name: 6-chloro-5-nitro-2-(phenylmethylthio)-4-pyrimidinamine IUPAC Name: 2-benzylsulfanyl-6-chloro-5-nitropyrimidin-4-amine Traditional Name: [2-(benzylthio)-6-chloro-5-nitro-pyrimidin-4-yl]amine Formula: C11H9ClN4O2S MolecularWeight: 296.73276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9ClN4O2S/c12-9-8(16(17)18)10(13)15-11(14-9)19-6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,13,14,15)