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

Systemtic Name: N-(4-ethylphenyl)-4-[(5-thiophen-3-yl-1-benzofuran-2-yl)methyl]piperazine-1-carboxamide Openeye Name: N-(4-ethylphenyl)-4-[[5-(3-thienyl)benzofuran-2-yl]methyl]piperazine-1-carboxamide CAS Name: N-(4-ethylphenyl)-4-[[5-(3-thiophenyl)-2-benzofuranyl]methyl]-1-piperazinecarboxamide IUPAC Name: N-(4-ethylphenyl)-4-[(5-thiophen-3-yl-1-benzofuran-2-yl)methyl]piperazine-1-carboxamide Traditional Name: N-(4-ethylphenyl)-4-[[5-(3-thienyl)benzofuran-2-yl]methyl]piperazine-1-carboxamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27N3O2S/c1-2-19-3-6-23(7-4-19)27-26(30)29-12-10-28(11-13-29)17-24-16-22-15-20(5-8-25(22)31-24)21-9-14-32-18-21/h3-9,14-16,18H,2,10-13,17H2,1H3,(H,27,30)