[4-[5-(sulfanylmethyl)-1,2-oxazol-3-yl]phenyl]methanethiol

Systemtic Name: [4-[5-(sulfanylmethyl)-1,2-oxazol-3-yl]phenyl]methanethiol Openeye Name: [4-[5-(sulfanylmethyl)isoxazol-3-yl]phenyl]methanethiol CAS Name: [4-[5-(mercaptomethyl)-3-isoxazolyl]phenyl]methanethiol IUPAC Name: [4-[5-(sulfanylmethyl)-1,2-oxazol-3-yl]phenyl]methanethiol Traditional Name: [4-[5-(mercaptomethyl)isoxazol-3-yl]phenyl]methanethiol Formula: C11H11NOS2 MolecularWeight: 237.34114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS)C2=NOC(=C2)CS

Isomeric SMILES

C1=CC(=CC=C1CS)C2=NOC(=C2)CS

InChI

InChI=1S/C11H11NOS2/c14-6-8-1-3-9(4-2-8)11-5-10(7-15)13-12-11/h1-5,14-15H,6-7H2