methyl N-cyano-N'-[[(2S,5S)-5-(1H-imidazol-5-yl)oxolan-2-yl]methyl]carbamimidothioate

Systemtic Name: methyl N-cyano-N'-[[(2S,5S)-5-(1H-imidazol-5-yl)oxolan-2-yl]methyl]carbamimidothioate Openeye Name: 1-cyano-3-[[(2S,5S)-5-(1H-imidazol-5-yl)tetrahydrofuran-2-yl]methyl]-2-methyl-isothiourea CAS Name: N-cyano-N'-[[(2S,5S)-5-(1H-imidazol-5-yl)-2-oxolanyl]methyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N-cyano-N'-[[(2S,5S)-5-(1H-imidazol-5-yl)oxolan-2-yl]methyl]carbamimidothioate Traditional Name: 1-cyano-3-[[(2S,5S)-5-(1H-imidazol-5-yl)tetrahydrofuran-2-yl]methyl]-2-methyl-isothiourea Formula: C11H15N5OS MolecularWeight: 265.3347

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCC1CCC(O1)C2=CN=CN2)NC#N

Isomeric SMILES

CSC(=NC[C@@H]1CC[C@H](O1)C2=CN=CN2)NC#N

InChI

InChI=1S/C11H15N5OS/c1-18-11(15-6-12)14-4-8-2-3-10(17-8)9-5-13-7-16-9/h5,7-8,10H,2-4H2,1H3,(H,13,16)(H,14,15)/t8-,10-/m0/s1