2-[4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-(3-chlorobenzothiophene-2-carbonyl)piperazin-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]-N-phenylacetamide IUPAC Name: 2-[4-(3-chloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]-N-phenylacetamide Traditional Name: 2-[4-(3-chlorobenzothiophene-2-carbonyl)piperazino]-N-phenyl-acetamide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H20ClN3O2S/c22-19-16-8-4-5-9-17(16)28-20(19)21(27)25-12-10-24(11-13-25)14-18(26)23-15-6-2-1-3-7-15/h1-9H,10-14H2,(H,23,26)