3-[[4-(aminomethyl)thian-4-yl]methyl]-2H-1,2,4-oxadiazol-5-one

Systemtic Name: 3-[[4-(aminomethyl)thian-4-yl]methyl]-2H-1,2,4-oxadiazol-5-one Openeye Name: 3-[[4-(aminomethyl)tetrahydrothiopyran-4-yl]methyl]-2H-1,2,4-oxadiazol-5-one CAS Name: 3-[[4-(aminomethyl)-4-thianyl]methyl]-2H-1,2,4-oxadiazol-5-one IUPAC Name: 3-[[4-(aminomethyl)thian-4-yl]methyl]-2H-1,2,4-oxadiazol-5-one Traditional Name: 3-[[4-(aminomethyl)tetrahydrothiopyran-4-yl]methyl]-2H-1,2,4-oxadiazol-5-one Formula: C9H15N3O2S MolecularWeight: 229.2993

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1(CC2=NC(=O)ON2)CN

Isomeric SMILES

C1CSCCC1(CC2=NC(=O)ON2)CN

InChI

InChI=1S/C9H15N3O2S/c10-6-9(1-3-15-4-2-9)5-7-11-8(13)14-12-7/h1-6,10H2,(H,11,12,13)