1-[4-(prop-1-ynylamino)phenyl]sulfonylazetidine-3-thiol

Systemtic Name: 1-[4-(prop-1-ynylamino)phenyl]sulfonylazetidine-3-thiol Openeye Name: 1-[4-(prop-1-ynylamino)phenyl]sulfonylazetidine-3-thiol CAS Name: 1-[4-(prop-1-ynylamino)phenyl]sulfonyl-3-azetidinethiol IUPAC Name: 1-[4-(prop-1-ynylamino)phenyl]sulfonylazetidine-3-thiol Traditional Name: 1-[4-(prop-1-ynylamino)phenyl]sulfonylazetidine-3-thiol Formula: C12H14N2O2S2 MolecularWeight: 282.38176

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Descriptors Computed from Structure

Canonical SMILES:

CC#CNC1=CC=C(C=C1)S(=O)(=O)N2CC(C2)S

Isomeric SMILES

CC#CNC1=CC=C(C=C1)S(=O)(=O)N2CC(C2)S

InChI

InChI=1S/C12H14N2O2S2/c1-2-7-13-10-3-5-12(6-4-10)18(15,16)14-8-11(17)9-14/h3-6,11,13,17H,8-9H2,1H3