ethyl 4-[2-ethanoylimino-5-(phenylcarbamoyl)-1,3,4-selenadiazol-3-yl]benzoate

Systemtic Name: ethyl 4-[2-ethanoylimino-5-(phenylcarbamoyl)-1,3,4-selenadiazol-3-yl]benzoate Openeye Name: ethyl 4-[2-acetylimino-5-(phenylcarbamoyl)-1,3,4-selenadiazol-3-yl]benzoate CAS Name: 4-[2-acetylimino-5-[anilino(oxo)methyl]-1,3,4-selenadiazol-3-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-acetylimino-5-(phenylcarbamoyl)-1,3,4-selenadiazol-3-yl]benzoate Traditional Name: 4-[2-acetylimino-5-(phenylcarbamoyl)-1,3,4-selenadiazol-3-yl]benzoic acid ethyl ester Formula: C20H18N4O4Se MolecularWeight: 457.34132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=NC(=O)C)[Se]C(=N2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=NC(=O)C)[Se]C(=N2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H18N4O4Se/c1-3-28-19(27)14-9-11-16(12-10-14)24-20(21-13(2)25)29-18(23-24)17(26)22-15-7-5-4-6-8-15/h4-12H,3H2,1-2H3,(H,22,26)