N-(4-ethylphenyl)-4-[(5-pyridin-3-yl-1-benzofuran-2-yl)methyl]piperazine-1-carboxamide

Systemtic Name: N-(4-ethylphenyl)-4-[(5-pyridin-3-yl-1-benzofuran-2-yl)methyl]piperazine-1-carboxamide Openeye Name: N-(4-ethylphenyl)-4-[[5-(3-pyridyl)benzofuran-2-yl]methyl]piperazine-1-carboxamide CAS Name: N-(4-ethylphenyl)-4-[[5-(3-pyridinyl)-2-benzofuranyl]methyl]-1-piperazinecarboxamide IUPAC Name: N-(4-ethylphenyl)-4-[(5-pyridin-3-yl-1-benzofuran-2-yl)methyl]piperazine-1-carboxamide Traditional Name: N-(4-ethylphenyl)-4-[[5-(3-pyridyl)benzofuran-2-yl]methyl]piperazine-1-carboxamide Formula: C27H28N4O2 MolecularWeight: 440.53682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)N2CCN(CC2)CC3=CC4=C(O3)C=CC(=C4)C5=CN=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)N2CCN(CC2)CC3=CC4=C(O3)C=CC(=C4)C5=CN=CC=C5

InChI

InChI=1S/C27H28N4O2/c1-2-20-5-8-24(9-6-20)29-27(32)31-14-12-30(13-15-31)19-25-17-23-16-21(7-10-26(23)33-25)22-4-3-11-28-18-22/h3-11,16-18H,2,12-15,19H2,1H3,(H,29,32)