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

Systemtic Name: 1-[2-[(3-bromanyl-1,2-oxazol-5-yl)methylsulfanyl]ethyl]-1-cyano-2-methyl-guanidine Openeye Name: 1-[2-[(3-bromoisoxazol-5-yl)methylsulfanyl]ethyl]-1-cyano-2-methyl-guanidine CAS Name: 1-[2-[(3-bromo-5-isoxazolyl)methylthio]ethyl]-1-cyano-2-methylguanidine IUPAC Name: 1-[2-[(3-bromo-1,2-oxazol-5-yl)methylsulfanyl]ethyl]-1-cyano-2-methylguanidine Traditional Name: 1-[2-[(3-bromoisoxazol-5-yl)methylthio]ethyl]-1-cyano-2-methyl-guanidine Formula: C9H12BrN5OS MolecularWeight: 318.19348

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)N(CCSCC1=CC(=NO1)Br)C#N

Isomeric SMILES

CN=C(N)N(CCSCC1=CC(=NO1)Br)C#N

InChI

InChI=1S/C9H12BrN5OS/c1-13-9(12)15(6-11)2-3-17-5-7-4-8(10)14-16-7/h4H,2-3,5H2,1H3,(H2,12,13)