3-chloranyl-6-fluoranyl-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-fluoranyl-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-fluoro-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-6-fluoro-N-[5-[(4-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-fluoro-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-fluoro-N-[5-[(4-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]benzothiophene-2-carboxamide Formula: C19H13ClFN3OS3 MolecularWeight: 449.972423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

InChI

InChI=1S/C19H13ClFN3OS3/c1-10-2-4-11(5-3-10)9-26-19-24-23-18(28-19)22-17(25)16-15(20)13-7-6-12(21)8-14(13)27-16/h2-8H,9H2,1H3,(H,22,23,25)