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

Systemtic Name: 4-fluoranyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-fluoro-benzothiophene-2-carboxamide CAS Name: 4-fluoro-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-fluoro-1-benzothiophene-2-carboxamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-4-fluoro-benzothiophene-2-carboxamide Formula: C18H12FN3OS3 MolecularWeight: 401.500783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC4=C(C=CC=C4S3)F

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC4=C(C=CC=C4S3)F

InChI

InChI=1S/C18H12FN3OS3/c19-13-7-4-8-14-12(13)9-15(25-14)16(23)20-17-21-22-18(26-17)24-10-11-5-2-1-3-6-11/h1-9H,10H2,(H,20,21,23)