2-[4-(1-benzothiophen-3-yl)-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenoxy]-N-(oxolan-2-ylmethyl)ethanamide

Systemtic Name: 2-[4-(1-benzothiophen-3-yl)-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenoxy]-N-(oxolan-2-ylmethyl)ethanamide Openeye Name: 2-[4-(benzothiophen-3-yl)-2-[[4-(2-pyridyl)piperazin-1-yl]methyl]phenoxy]-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: 2-[4-(1-benzothiophen-3-yl)-2-[[4-(2-pyridinyl)-1-piperazinyl]methyl]phenoxy]-N-(2-oxolanylmethyl)acetamide IUPAC Name: 2-[4-(1-benzothiophen-3-yl)-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenoxy]-N-(oxolan-2-ylmethyl)acetamide Traditional Name: 2-[4-(benzothiophen-3-yl)-2-[[4-(2-pyridyl)piperazino]methyl]phenoxy]-N-(tetrahydrofurfuryl)acetamide Formula: C31H34N4O3S MolecularWeight: 542.69166

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)COC2=C(C=C(C=C2)C3=CSC4=CC=CC=C43)CN5CCN(CC5)C6=CC=CC=N6

Isomeric SMILES

C1CC(OC1)CNC(=O)COC2=C(C=C(C=C2)C3=CSC4=CC=CC=C43)CN5CCN(CC5)C6=CC=CC=N6

InChI

InChI=1S/C31H34N4O3S/c36-31(33-19-25-6-5-17-37-25)21-38-28-11-10-23(27-22-39-29-8-2-1-7-26(27)29)18-24(28)20-34-13-15-35(16-14-34)30-9-3-4-12-32-30/h1-4,7-12,18,22,25H,5-6,13-17,19-21H2,(H,33,36)