3-phenyl-N-[5-(thiophen-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-5-carboxamide

Systemtic Name: 3-phenyl-N-[5-(thiophen-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-5-carboxamide Openeye Name: 3-phenyl-N-[5-(2-thienylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]isoxazole-5-carboxamide CAS Name: 3-phenyl-N-[5-(thiophen-2-ylmethylthio)-1,3,4-thiadiazol-2-yl]-5-isoxazolecarboxamide IUPAC Name: 3-phenyl-N-[5-(thiophen-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-5-carboxamide Traditional Name: 3-phenyl-N-[5-(2-thenylthio)-1,3,4-thiadiazol-2-yl]isoxazole-5-carboxamide Formula: C17H12N4O2S3 MolecularWeight: 400.49778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NOC(=C2)C(=O)NC3=NN=C(S3)SCC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=NOC(=C2)C(=O)NC3=NN=C(S3)SCC4=CC=CS4

InChI

InChI=1S/C17H12N4O2S3/c22-15(14-9-13(21-23-14)11-5-2-1-3-6-11)18-16-19-20-17(26-16)25-10-12-7-4-8-24-12/h1-9H,10H2,(H,18,19,22)