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

Systemtic Name: 3-chloranyl-N-[2-(4-phenylpiperazin-1-yl)carbonylphenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]benzothiophene-2-carboxamide Formula: C26H22ClN3O2S MolecularWeight: 475.98978

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CC=C3NC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CC=C3NC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C26H22ClN3O2S/c27-23-20-11-5-7-13-22(20)33-24(23)25(31)28-21-12-6-4-10-19(21)26(32)30-16-14-29(15-17-30)18-8-2-1-3-9-18/h1-13H,14-17H2,(H,28,31)