N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-2-(3-pyridyl)ethyl]thiophene-2-carboxamide CAS Name: N-[2-[4-(phenylmethyl)-1-piperazinyl]-2-(3-pyridinyl)ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)-2-pyridin-3-ylethyl]thiophene-2-carboxamide Traditional Name: N-[2-(4-benzylpiperazino)-2-(3-pyridyl)ethyl]thiophene-2-carboxamide Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(CNC(=O)C3=CC=CS3)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(CNC(=O)C3=CC=CS3)C4=CN=CC=C4

InChI

InChI=1S/C23H26N4OS/c28-23(22-9-5-15-29-22)25-17-21(20-8-4-10-24-16-20)27-13-11-26(12-14-27)18-19-6-2-1-3-7-19/h1-10,15-16,21H,11-14,17-18H2,(H,25,28)