2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[5-[[(tert-butylamino)-oxomethyl]amino]-1,3,4-thiadiazol-2-yl]thio]-N-phenethylacetamide IUPAC Name: 2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenethylacetamide Traditional Name: 2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]thio]-N-phenethyl-acetamide Formula: C17H23N5O2S2 MolecularWeight: 393.52682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC1=NN=C(S1)SCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC(=O)NC1=NN=C(S1)SCC(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C17H23N5O2S2/c1-17(2,3)20-14(24)19-15-21-22-16(26-15)25-11-13(23)18-10-9-12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3,(H,18,23)(H2,19,20,21,24)