[(2E)-2-(1-isocyanoethylidene)-5-phenyl-1,3-oxazolidin-4-yl]methanethiol

Systemtic Name: [(2E)-2-(1-isocyanoethylidene)-5-phenyl-1,3-oxazolidin-4-yl]methanethiol Openeye Name: [(2E)-2-(1-isocyanoethylidene)-5-phenyl-oxazolidin-4-yl]methanethiol CAS Name: [(2E)-2-(1-isocyanoethylidene)-5-phenyl-4-oxazolidinyl]methanethiol IUPAC Name: [(2E)-2-(1-isocyanoethylidene)-5-phenyl-1,3-oxazolidin-4-yl]methanethiol Traditional Name: [(2E)-2-(1-isocyanoethylidene)-5-phenyl-oxazolidin-4-yl]methanethiol Formula: C13H14N2OS MolecularWeight: 246.32806

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1NC(C(O1)C2=CC=CC=C2)CS)[N+]#[C-]

Isomeric SMILES

C/C(=C\1/NC(C(O1)C2=CC=CC=C2)CS)/[N+]#[C-]

InChI

InChI=1S/C13H14N2OS/c1-9(14-2)13-15-11(8-17)12(16-13)10-6-4-3-5-7-10/h3-7,11-12,15,17H,8H2,1H3/b13-9+