N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[2-(phenylmethylsulfanyl)ethanoylamino]benzamide

Systemtic Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[2-(phenylmethylsulfanyl)ethanoylamino]benzamide Openeye Name: 2-[(2-benzylsulfanylacetyl)amino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[1-oxo-2-(phenylmethylthio)ethyl]amino]benzamide IUPAC Name: 2-[(2-benzylsulfanylacetyl)amino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 2-[[2-(benzylthio)acetyl]amino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C2=CC=CC=C2NC(=O)CSCC3=CC=CC=C3

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)C2=CC=CC=C2NC(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C20H20N4O2S2/c1-2-18-23-24-20(28-18)22-19(26)15-10-6-7-11-16(15)21-17(25)13-27-12-14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H,21,25)(H,22,24,26)