2-[5-chloranyl-6-(2-methylpropoxy)-1,2-benzoxazol-3-yl]ethanethiol

Systemtic Name: 2-[5-chloranyl-6-(2-methylpropoxy)-1,2-benzoxazol-3-yl]ethanethiol Openeye Name: 2-(5-chloro-6-isobutoxy-1,2-benzoxazol-3-yl)ethanethiol CAS Name: 2-[5-chloro-6-(2-methylpropoxy)-1,2-benzoxazol-3-yl]ethanethiol IUPAC Name: 2-[5-chloro-6-(2-methylpropoxy)-1,2-benzoxazol-3-yl]ethanethiol Traditional Name: 2-(5-chloro-6-isobutoxy-indoxazen-3-yl)ethanethiol Formula: C13H16ClNO2S MolecularWeight: 285.78964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C2C(=C1)ON=C2CCS)Cl

Isomeric SMILES

CC(C)COC1=C(C=C2C(=C1)ON=C2CCS)Cl

InChI

InChI=1S/C13H16ClNO2S/c1-8(2)7-16-13-6-12-9(5-10(13)14)11(3-4-18)15-17-12/h5-6,8,18H,3-4,7H2,1-2H3