(3S)-N-(2-isothiocyanatoethyl)-2,2,5,5-tetramethyl-1-oxidanyl-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(2-isothiocyanatoethyl)-2,2,5,5-tetramethyl-1-oxidanyl-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-hydroxy-N-(2-isothiocyanatoethyl)-2,2,5,5-tetramethyl-pyrrolidine-3-carboxamide CAS Name: (3S)-1-hydroxy-N-(2-isothiocyanatoethyl)-2,2,5,5-tetramethyl-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-hydroxy-N-(2-isothiocyanatoethyl)-2,2,5,5-tetramethylpyrrolidine-3-carboxamide Traditional Name: (3S)-1-hydroxy-N-(2-isothiocyanatoethyl)-2,2,5,5-tetramethyl-pyrrolidine-3-carboxamide Formula: C12H21N3O2S MolecularWeight: 271.37904

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(N1O)(C)C)C(=O)NCCN=C=S)C

Isomeric SMILES

CC1(C[C@@H](C(N1O)(C)C)C(=O)NCCN=C=S)C

InChI

InChI=1S/C12H21N3O2S/c1-11(2)7-9(12(3,4)15(11)17)10(16)14-6-5-13-8-18/h9,17H,5-7H2,1-4H3,(H,14,16)/t9-/m1/s1