2-[4-(prop-1-ynylamino)phenyl]sulfonyl-1,2-oxazolidine-4-thiol

Systemtic Name: 2-[4-(prop-1-ynylamino)phenyl]sulfonyl-1,2-oxazolidine-4-thiol Openeye Name: 2-[4-(prop-1-ynylamino)phenyl]sulfonylisoxazolidine-4-thiol CAS Name: 2-[4-(prop-1-ynylamino)phenyl]sulfonyl-4-isoxazolidinethiol IUPAC Name: 2-[4-(prop-1-ynylamino)phenyl]sulfonyl-1,2-oxazolidine-4-thiol Traditional Name: 2-[4-(prop-1-ynylamino)phenyl]sulfonylisoxazolidine-4-thiol Formula: C12H14N2O3S2 MolecularWeight: 298.38116

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Descriptors Computed from Structure

Canonical SMILES:

CC#CNC1=CC=C(C=C1)S(=O)(=O)N2CC(CO2)S

Isomeric SMILES

CC#CNC1=CC=C(C=C1)S(=O)(=O)N2CC(CO2)S

InChI

InChI=1S/C12H14N2O3S2/c1-2-7-13-10-3-5-12(6-4-10)19(15,16)14-8-11(18)9-17-14/h3-6,11,13,18H,8-9H2,1H3