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

Systemtic Name: N-(4-ethylphenyl)-N-[2-oxidanylidene-2-(phenethylamino)ethyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-(4-ethylphenyl)-N-[2-oxo-2-(phenethylamino)ethyl]thiadiazole-4-carboxamide CAS Name: N-(4-ethylphenyl)-N-[2-oxo-2-(phenethylamino)ethyl]-4-thiadiazolecarboxamide IUPAC Name: N-(4-ethylphenyl)-N-[2-oxo-2-(phenethylamino)ethyl]thiadiazole-4-carboxamide Traditional Name: N-(4-ethylphenyl)-N-[2-keto-2-(phenethylamino)ethyl]thiadiazole-4-carboxamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC(=O)NCCC2=CC=CC=C2)C(=O)C3=CSN=N3

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC(=O)NCCC2=CC=CC=C2)C(=O)C3=CSN=N3

InChI

InChI=1S/C21H22N4O2S/c1-2-16-8-10-18(11-9-16)25(21(27)19-15-28-24-23-19)14-20(26)22-13-12-17-6-4-3-5-7-17/h3-11,15H,2,12-14H2,1H3,(H,22,26)