S-(phenylmethyl) 3,3-dimethylazetidine-1-carbothioate

Systemtic Name: S-(phenylmethyl) 3,3-dimethylazetidine-1-carbothioate Openeye Name: S-benzyl 3,3-dimethylazetidine-1-carbothioate CAS Name: 3,3-dimethyl-1-azetidinecarbothioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl 3,3-dimethylazetidine-1-carbothioate Traditional Name: 3,3-dimethylazetidine-1-carbothioic acid S-benzyl ester Formula: C13H17NOS MolecularWeight: 235.34518

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C1)C(=O)SCC2=CC=CC=C2)C

Isomeric SMILES

CC1(CN(C1)C(=O)SCC2=CC=CC=C2)C

InChI

InChI=1S/C13H17NOS/c1-13(2)9-14(10-13)12(15)16-8-11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3