1-cyano-2-methyl-1-[2-[(5-oxidanylidene-1,2-dihydropyrazol-3-yl)methylsulfanyl]ethyl]guanidine

Systemtic Name: 1-cyano-2-methyl-1-[2-[(5-oxidanylidene-1,2-dihydropyrazol-3-yl)methylsulfanyl]ethyl]guanidine Openeye Name: 1-cyano-2-methyl-1-[2-[(5-oxo-1,2-dihydropyrazol-3-yl)methylsulfanyl]ethyl]guanidine CAS Name: 1-cyano-2-methyl-1-[2-[(5-oxo-1,2-dihydropyrazol-3-yl)methylthio]ethyl]guanidine IUPAC Name: 1-cyano-2-methyl-1-[2-[(5-oxo-1,2-dihydropyrazol-3-yl)methylsulfanyl]ethyl]guanidine Traditional Name: 1-cyano-1-[2-[(5-keto-3-pyrazolin-3-yl)methylthio]ethyl]-2-methyl-guanidine Formula: C9H14N6OS MolecularWeight: 254.31206

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)N(CCSCC1=CC(=O)NN1)C#N

Isomeric SMILES

CN=C(N)N(CCSCC1=CC(=O)NN1)C#N

InChI

InChI=1S/C9H14N6OS/c1-12-9(11)15(6-10)2-3-17-5-7-4-8(16)14-13-7/h4H,2-3,5H2,1H3,(H2,11,12)(H2,13,14,16)