S-[3-(1,3-benzoxazol-2-yl)-3-methyl-butan-2-yl] ethanethioate

Systemtic Name: S-[3-(1,3-benzoxazol-2-yl)-3-methyl-butan-2-yl] ethanethioate Openeye Name: S-[2-(1,3-benzoxazol-2-yl)-1,2-dimethyl-propyl] ethanethioate CAS Name: ethanethioic acid S-[3-(1,3-benzoxazol-2-yl)-3-methylbutan-2-yl] ester IUPAC Name: S-[3-(1,3-benzoxazol-2-yl)-3-methylbutan-2-yl] ethanethioate Traditional Name: ethanethioic acid S-[2-(1,3-benzoxazol-2-yl)-1,2-dimethyl-propyl] ester Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C1=NC2=CC=CC=C2O1)SC(=O)C

Isomeric SMILES

CC(C(C)(C)C1=NC2=CC=CC=C2O1)SC(=O)C

InChI

InChI=1S/C14H17NO2S/c1-9(18-10(2)16)14(3,4)13-15-11-7-5-6-8-12(11)17-13/h5-9H,1-4H3