3-[3,5-bis(azanyl)-6-chloranyl-pyrazin-2-yl]-2-methyl-4-prop-2-enyl-1H-1,2,4-triazol-4-ium-5-thione

Systemtic Name: 3-[3,5-bis(azanyl)-6-chloranyl-pyrazin-2-yl]-2-methyl-4-prop-2-enyl-1H-1,2,4-triazol-4-ium-5-thione Openeye Name: 4-allyl-3-(3,5-diamino-6-chloro-pyrazin-2-yl)-2-methyl-1H-1,2,4-triazol-4-ium-5-thione CAS Name: 3-(3,5-diamino-6-chloro-2-pyrazinyl)-2-methyl-4-prop-2-enyl-1H-1,2,4-triazol-4-ium-5-thione IUPAC Name: 3-(3,5-diamino-6-chloropyrazin-2-yl)-2-methyl-4-prop-2-enyl-1H-1,2,4-triazol-4-ium-5-thione Traditional Name: 4-allyl-3-(3,5-diamino-6-chloro-pyrazin-2-yl)-2-methyl-1H-1,2,4-triazol-4-ium-5-thione Formula: C10H13ClN7S+ MolecularWeight: 298.77512

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=[N+](C(=S)N1)CC=C)C2=C(N=C(C(=N2)Cl)N)N

Isomeric SMILES

CN1C(=[N+](C(=S)N1)CC=C)C2=C(N=C(C(=N2)Cl)N)N

InChI

InChI=1S/C10H12ClN7S/c1-3-4-18-9(17(2)16-10(18)19)5-7(12)15-8(13)6(11)14-5/h3H,1,4H2,2H3,(H4,12,13,15,16,19)/p+1