S-phenyl (2E)-2-[1-(benzenecarbonothioyl)imidazolidin-2-ylidene]-2-nitro-ethanethioate

Systemtic Name: S-phenyl (2E)-2-[1-(benzenecarbonothioyl)imidazolidin-2-ylidene]-2-nitro-ethanethioate Openeye Name: S-phenyl (2E)-2-[1-(benzenecarbonothioyl)imidazolidin-2-ylidene]-2-nitro-ethanethioate CAS Name: (2E)-2-[1-(benzenecarbonothioyl)-2-imidazolidinylidene]-2-nitroethanethioic acid S-phenyl ester IUPAC Name: S-phenyl (2E)-2-[1-(benzenecarbonothioyl)imidazolidin-2-ylidene]-2-nitroethanethioate Traditional Name: (2E)-2-[1-(benzenecarbonothioyl)imidazolidin-2-ylidene]-2-nitro-ethanethioic acid S-phenyl ester Formula: C18H15N3O3S2 MolecularWeight: 385.46

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=C(C(=O)SC2=CC=CC=C2)[N+](=O)[O-])N1)C(=S)C3=CC=CC=C3

Isomeric SMILES

C1CN(/C(=C(\C(=O)SC2=CC=CC=C2)/[N+](=O)[O-])/N1)C(=S)C3=CC=CC=C3

InChI

InChI=1S/C18H15N3O3S2/c22-18(26-14-9-5-2-6-10-14)15(21(23)24)16-19-11-12-20(16)17(25)13-7-3-1-4-8-13/h1-10,19H,11-12H2/b16-15+