2-benzo[e][1,2]benzoxazol-1-ylethanethiol

Systemtic Name: 2-benzo[e][1,2]benzoxazol-1-ylethanethiol Openeye Name: 2-benzo[e][1,2]benzoxazol-1-ylethanethiol CAS Name: 2-(1-benzo[e][1,2]benzoxazolyl)ethanethiol IUPAC Name: 2-benzo[e][1,2]benzoxazol-1-ylethanethiol Traditional Name: 2-benz[e]indoxazen-1-ylethanethiol Formula: C13H11NOS MolecularWeight: 229.29754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=NO3)CCS

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=NO3)CCS

InChI

InChI=1S/C13H11NOS/c16-8-7-11-13-10-4-2-1-3-9(10)5-6-12(13)15-14-11/h1-6,16H,7-8H2