3-chloranyl-N-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-keto-2-(4-phenylpiperazino)ethyl]benzothiophene-2-carboxamide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CNC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CNC(=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)23-14-18(26)25-12-10-24(11-13-25)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,23,27)