S-(phenylmethyl) 2,2,4-trimethylazetidine-1-carbothioate

Systemtic Name: S-(phenylmethyl) 2,2,4-trimethylazetidine-1-carbothioate Openeye Name: S-benzyl 2,2,4-trimethylazetidine-1-carbothioate CAS Name: 2,2,4-trimethyl-1-azetidinecarbothioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl 2,2,4-trimethylazetidine-1-carbothioate Traditional Name: 2,2,4-trimethylazetidine-1-carbothioic acid S-benzyl ester Formula: C14H19NOS MolecularWeight: 249.37176

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N1C(=O)SCC2=CC=CC=C2)(C)C

Isomeric SMILES

CC1CC(N1C(=O)SCC2=CC=CC=C2)(C)C

InChI

InChI=1S/C14H19NOS/c1-11-9-14(2,3)15(11)13(16)17-10-12-7-5-4-6-8-12/h4-8,11H,9-10H2,1-3H3