(E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(4-hydroxy-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(4-hydroxy-3-nitrophenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(4-hydroxy-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(4-hydroxy-3-nitro-phenyl)acrylamide Formula: C14H11N5O4S MolecularWeight: 345.33324

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C(=CC2=CC(=C(C=C2)O)[N+](=O)[O-])C#N

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)/C(=C/C2=CC(=C(C=C2)O)[N+](=O)[O-])/C#N

InChI

InChI=1S/C14H11N5O4S/c1-2-12-17-18-14(24-12)16-13(21)9(7-15)5-8-3-4-11(20)10(6-8)19(22)23/h3-6,20H,2H2,1H3,(H,16,18,21)/b9-5+