2-(7-bromanyl-5-propan-2-yl-1,2-benzoxazol-3-yl)ethanethiol

Systemtic Name: 2-(7-bromanyl-5-propan-2-yl-1,2-benzoxazol-3-yl)ethanethiol Openeye Name: 2-(7-bromo-5-isopropyl-1,2-benzoxazol-3-yl)ethanethiol CAS Name: 2-(7-bromo-5-propan-2-yl-1,2-benzoxazol-3-yl)ethanethiol IUPAC Name: 2-(7-bromo-5-propan-2-yl-1,2-benzoxazol-3-yl)ethanethiol Traditional Name: 2-(7-bromo-5-isopropyl-indoxazen-3-yl)ethanethiol Formula: C12H14BrNOS MolecularWeight: 300.21466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C(=C1)C(=NO2)CCS)Br

Isomeric SMILES

CC(C)C1=CC(=C2C(=C1)C(=NO2)CCS)Br

InChI

InChI=1S/C12H14BrNOS/c1-7(2)8-5-9-11(3-4-16)14-15-12(9)10(13)6-8/h5-7,16H,3-4H2,1-2H3