methyl N'-[3,5-bis(azanyl)-6-chloranyl-pyrazin-2-yl]carbamimidothioate

Systemtic Name: methyl N'-[3,5-bis(azanyl)-6-chloranyl-pyrazin-2-yl]carbamimidothioate Openeye Name: 3-(3,5-diamino-6-chloro-pyrazin-2-yl)-2-methyl-isothiourea CAS Name: N'-(3,5-diamino-6-chloro-2-pyrazinyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(3,5-diamino-6-chloropyrazin-2-yl)carbamimidothioate Traditional Name: 3-(3,5-diamino-6-chloro-pyrazin-2-yl)-2-methyl-isothiourea Formula: C6H9ClN6S MolecularWeight: 232.69386

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=C(N=C(C(=N1)Cl)N)N)N

Isomeric SMILES

CS/C(=N\C1=C(N=C(C(=N1)Cl)N)N)/N

InChI

InChI=1S/C6H9ClN6S/c1-14-6(10)13-5-4(9)12-3(8)2(7)11-5/h1H3,(H4,8,9,12)(H2,10,11,13)