3-chloranyl-N-[4-(2-fluorophenyl)piperazin-1-yl]carbothioyl-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(2-fluorophenyl)piperazin-1-yl]carbothioyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-(2-fluorophenyl)piperazine-1-carbothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[4-(2-fluorophenyl)-1-piperazinyl]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-(2-fluorophenyl)piperazine-1-carbothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(2-fluorophenyl)piperazine-1-carbothioyl]benzothiophene-2-carboxamide Formula: C20H17ClFN3OS2 MolecularWeight: 433.949883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C20H17ClFN3OS2/c21-17-13-5-1-4-8-16(13)28-18(17)19(26)23-20(27)25-11-9-24(10-12-25)15-7-3-2-6-14(15)22/h1-8H,9-12H2,(H,23,26,27)