N-(4-ethanoylphenyl)-N-[2-oxidanylidene-2-(phenethylamino)ethyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-(4-ethanoylphenyl)-N-[2-oxidanylidene-2-(phenethylamino)ethyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-(4-acetylphenyl)-N-[2-oxo-2-(phenethylamino)ethyl]thiadiazole-4-carboxamide CAS Name: N-(4-acetylphenyl)-N-[2-oxo-2-(phenethylamino)ethyl]-4-thiadiazolecarboxamide IUPAC Name: N-(4-acetylphenyl)-N-[2-oxo-2-(phenethylamino)ethyl]thiadiazole-4-carboxamide Traditional Name: N-(4-acetylphenyl)-N-[2-keto-2-(phenethylamino)ethyl]thiadiazole-4-carboxamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N(CC(=O)NCCC2=CC=CC=C2)C(=O)C3=CSN=N3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N(CC(=O)NCCC2=CC=CC=C2)C(=O)C3=CSN=N3

InChI

InChI=1S/C21H20N4O3S/c1-15(26)17-7-9-18(10-8-17)25(21(28)19-14-29-24-23-19)13-20(27)22-12-11-16-5-3-2-4-6-16/h2-10,14H,11-13H2,1H3,(H,22,27)