2-ethanimidoyl-4-[1-(4-fluorophenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: 2-ethanimidoyl-4-[1-(4-fluorophenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-ethanimidoyl-4-[1-(4-fluorophenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-3-oxo-butanenitrile CAS Name: 4-[[1-(4-fluorophenyl)-5-nitro-2-benzimidazolyl]thio]-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: 2-ethanimidoyl-4-[1-(4-fluorophenyl)-5-nitrobenzimidazol-2-yl]sulfanyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-4-[[1-(4-fluorophenyl)-5-nitro-benzimidazol-2-yl]thio]-3-keto-butyronitrile Formula: C19H14FN5O3S MolecularWeight: 411.409563

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NC2=C(N1C3=CC=C(C=C3)F)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NC2=C(N1C3=CC=C(C=C3)F)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H14FN5O3S/c1-11(22)15(9-21)18(26)10-29-19-23-16-8-14(25(27)28)6-7-17(16)24(19)13-4-2-12(20)3-5-13/h2-8,15,22H,10H2,1H3