2-[(2-chloranyl-6-nitro-phenyl)methylsulfanyl]pyrimidine-4,6-diamine

Systemtic Name: 2-[(2-chloranyl-6-nitro-phenyl)methylsulfanyl]pyrimidine-4,6-diamine Openeye Name: 2-[(2-chloro-6-nitro-phenyl)methylsulfanyl]pyrimidine-4,6-diamine CAS Name: 2-[(2-chloro-6-nitrophenyl)methylthio]pyrimidine-4,6-diamine IUPAC Name: 2-[(2-chloro-6-nitrophenyl)methylsulfanyl]pyrimidine-4,6-diamine Traditional Name: [6-amino-2-[(2-chloro-6-nitro-benzyl)thio]pyrimidin-4-yl]amine Formula: C11H10ClN5O2S MolecularWeight: 311.7474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10ClN5O2S/c12-7-2-1-3-8(17(18)19)6(7)5-20-11-15-9(13)4-10(14)16-11/h1-4H,5H2,(H4,13,14,15,16)