5-[3-[4,6-bis(azanyl)pyrimidin-5-yl]sulfanyl-5-chloranyl-pyrazin-2-yl]sulfanylpyrimidine-4,6-diamine

Systemtic Name: 5-[3-[4,6-bis(azanyl)pyrimidin-5-yl]sulfanyl-5-chloranyl-pyrazin-2-yl]sulfanylpyrimidine-4,6-diamine Openeye Name: 5-[5-chloro-3-(4,6-diaminopyrimidin-5-yl)sulfanyl-pyrazin-2-yl]sulfanylpyrimidine-4,6-diamine CAS Name: 5-[[5-chloro-3-[(4,6-diamino-5-pyrimidinyl)thio]-2-pyrazinyl]thio]pyrimidine-4,6-diamine IUPAC Name: 5-[5-chloro-3-(4,6-diaminopyrimidin-5-yl)sulfanylpyrazin-2-yl]sulfanylpyrimidine-4,6-diamine Traditional Name: [6-amino-5-[[5-chloro-3-[(4,6-diaminopyrimidin-5-yl)thio]pyrazin-2-yl]thio]pyrimidin-4-yl]amine Formula: C12H11ClN10S2 MolecularWeight: 394.86574

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(C(=N1)SC2=C(N=CN=C2N)N)SC3=C(N=CN=C3N)N)Cl

Isomeric SMILES

C1=C(N=C(C(=N1)SC2=C(N=CN=C2N)N)SC3=C(N=CN=C3N)N)Cl

InChI

InChI=1S/C12H11ClN10S2/c13-4-1-18-11(24-5-7(14)19-2-20-8(5)15)12(23-4)25-6-9(16)21-3-22-10(6)17/h1-3H,(H4,14,15,19,20)(H4,16,17,21,22)