N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(3-phenylbutanoylamino)benzamide

Systemtic Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(3-phenylbutanoylamino)benzamide Openeye Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(3-phenylbutanoylamino)benzamide CAS Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(1-oxo-3-phenylbutyl)amino]benzamide IUPAC Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(3-phenylbutanoylamino)benzamide Traditional Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(3-phenylbutanoylamino)benzamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C2=CC=CC=C2NC(=O)CC(C)C3=CC=CC=C3

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)C2=CC=CC=C2NC(=O)CC(C)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2S/c1-3-19-24-25-21(28-19)23-20(27)16-11-7-8-12-17(16)22-18(26)13-14(2)15-9-5-4-6-10-15/h4-12,14H,3,13H2,1-2H3,(H,22,26)(H,23,25,27)