[(3R)-5-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-3-cyano-4-oxidanylidene-pent-1-en-2-yl]azanium

Systemtic Name: [(3R)-5-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-3-cyano-4-oxidanylidene-pent-1-en-2-yl]azanium Openeye Name: [(2R)-4-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-2-cyano-1-methylene-3-oxo-butyl]ammonium CAS Name: [(3R)-5-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-3-cyano-4-oxopent-1-en-2-yl]ammonium IUPAC Name: [(3R)-5-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-3-cyano-4-oxopent-1-en-2-yl]azanium Traditional Name: 1-[(1R)-3-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-cyano-2-keto-propyl]vinylammonium Formula: C8H11N6OS+ MolecularWeight: 239.27754

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(C#N)C(=O)CSC1=NNC(=N1)N)[NH3+]

Isomeric SMILES

C=C([C@H](C#N)C(=O)CSC1=NNC(=N1)N)[NH3+]

InChI

InChI=1S/C8H10N6OS/c1-4(10)5(2-9)6(15)3-16-8-12-7(11)13-14-8/h5H,1,3,10H2,(H3,11,12,13,14)/p+1/t5-/m0/s1