N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-fluoro-benzothiophene-2-carboxamide CAS Name: N-[5-[(4-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-4-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-fluoro-1-benzothiophene-2-carboxamide Traditional Name: N-[5-[(4-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]-4-fluoro-benzothiophene-2-carboxamide Formula: C19H11FN4OS3 MolecularWeight: 426.510243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(SC2=C1)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)C#N)F

Isomeric SMILES

C1=CC(=C2C=C(SC2=C1)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)C#N)F

InChI

InChI=1S/C19H11FN4OS3/c20-14-2-1-3-15-13(14)8-16(27-15)17(25)22-18-23-24-19(28-18)26-10-12-6-4-11(9-21)5-7-12/h1-8H,10H2,(H,22,23,25)