N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2-(4-fluorophenyl)sulfanyl-ethanamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2-(4-fluorophenyl)sulfanyl-ethanamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-2-(4-fluorophenyl)sulfanyl-acetamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-2-[(4-fluorophenyl)thio]acetamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-2-(4-fluorophenyl)sulfanylacetamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-2-[(4-fluorophenyl)thio]acetamide Formula: C18H17ClFN3O2S MolecularWeight: 393.862883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)CSC3=CC=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)CSC3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C18H17ClFN3O2S/c19-15-9-13(3-6-16(15)23-8-7-21-17(24)10-23)22-18(25)11-26-14-4-1-12(20)2-5-14/h1-6,9H,7-8,10-11H2,(H,21,24)(H,22,25)