N-[3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Openeye Name: N-[3-[[4-(2-pyridyl)piperazin-1-yl]methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]furan-2-carboxamide CAS Name: N-[3-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-furancarboxamide IUPAC Name: N-[3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Traditional Name: N-[3-[[4-(2-pyridyl)piperazino]methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-furamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CO3)CN4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CO3)CN4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C23H26N4O2S/c28-22(19-7-5-15-29-19)25-23-18(17-6-1-2-8-20(17)30-23)16-26-11-13-27(14-12-26)21-9-3-4-10-24-21/h3-5,7,9-10,15H,1-2,6,8,11-14,16H2,(H,25,28)