S-phenyl 1-tert-butyl-2-[oxidanyl(phenyl)methyl]aziridine-2-carbothioate

Systemtic Name: S-phenyl 1-tert-butyl-2-[oxidanyl(phenyl)methyl]aziridine-2-carbothioate Openeye Name: S-phenyl 1-tert-butyl-2-[hydroxy(phenyl)methyl]aziridine-2-carbothioate CAS Name: 1-tert-butyl-2-[hydroxy(phenyl)methyl]-2-aziridinecarbothioic acid S-phenyl ester IUPAC Name: S-phenyl 1-tert-butyl-2-[hydroxy(phenyl)methyl]aziridine-2-carbothioate Traditional Name: 1-tert-butyl-2-[hydroxy(phenyl)methyl]ethylenimine-2-carbothioic acid S-phenyl ester Formula: C20H23NO2S MolecularWeight: 341.46712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC1(C(C2=CC=CC=C2)O)C(=O)SC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N1CC1(C(C2=CC=CC=C2)O)C(=O)SC3=CC=CC=C3

InChI

InChI=1S/C20H23NO2S/c1-19(2,3)21-14-20(21,17(22)15-10-6-4-7-11-15)18(23)24-16-12-8-5-9-13-16/h4-13,17,22H,14H2,1-3H3