4-[4-(3-phenylpropyl)piperazin-1-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 4-[4-(3-phenylpropyl)piperazin-1-yl]-1-benzothiophene-2-carboxamide Openeye Name: 4-[4-(3-phenylpropyl)piperazin-1-yl]benzothiophene-2-carboxamide CAS Name: 4-[4-(3-phenylpropyl)-1-piperazinyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4-[4-(3-phenylpropyl)piperazin-1-yl]-1-benzothiophene-2-carboxamide Traditional Name: 4-[4-(3-phenylpropyl)piperazino]benzothiophene-2-carboxamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC=CC=C2)C3=C4C=C(SC4=CC=C3)C(=O)N

Isomeric SMILES

C1CN(CCN1CCCC2=CC=CC=C2)C3=C4C=C(SC4=CC=C3)C(=O)N

InChI

InChI=1S/C22H25N3OS/c23-22(26)21-16-18-19(9-4-10-20(18)27-21)25-14-12-24(13-15-25)11-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10,16H,5,8,11-15H2,(H2,23,26)