N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[3-(propanoylamino)phenyl]carbonylamino]benzamide

Systemtic Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[3-(propanoylamino)phenyl]carbonylamino]benzamide Openeye Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[3-(propanoylamino)benzoyl]amino]benzamide CAS Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[oxo-[3-(1-oxopropylamino)phenyl]methyl]amino]benzamide IUPAC Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[3-(propanoylamino)benzoyl]amino]benzamide Traditional Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-propionamidobenzoyl)amino]benzamide Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N5O3S/c1-3-17(27)22-14-9-7-8-13(12-14)19(28)23-16-11-6-5-10-15(16)20(29)24-21-26-25-18(4-2)30-21/h5-12H,3-4H2,1-2H3,(H,22,27)(H,23,28)(H,24,26,29)