N-(3-fluorophenyl)-4-[(5-thiophen-3-yl-1-benzofuran-2-yl)methyl]-1,4-diazepane-1-carboxamide hydrochloride

Systemtic Name: N-(3-fluorophenyl)-4-[(5-thiophen-3-yl-1-benzofuran-2-yl)methyl]-1,4-diazepane-1-carboxamide hydrochloride Openeye Name: N-(3-fluorophenyl)-4-[[5-(3-thienyl)benzofuran-2-yl]methyl]-1,4-diazepane-1-carboxamide hydrochloride CAS Name: N-(3-fluorophenyl)-4-[[5-(3-thiophenyl)-2-benzofuranyl]methyl]-1,4-diazepane-1-carboxamide hydrochloride IUPAC Name: N-(3-fluorophenyl)-4-[(5-thiophen-3-yl-1-benzofuran-2-yl)methyl]-1,4-diazepane-1-carboxamide hydrochloride Traditional Name: N-(3-fluorophenyl)-4-[[5-(3-thienyl)benzofuran-2-yl]methyl]-1,4-diazepane-1-carboxamide hydrochloride Formula: C25H25ClFN3O2S MolecularWeight: 486.001303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NC2=CC(=CC=C2)F)CC3=CC4=C(O3)C=CC(=C4)C5=CSC=C5.Cl

Isomeric SMILES

C1CN(CCN(C1)C(=O)NC2=CC(=CC=C2)F)CC3=CC4=C(O3)C=CC(=C4)C5=CSC=C5.Cl

InChI

InChI=1S/C25H24FN3O2S.ClH/c26-21-3-1-4-22(15-21)27-25(30)29-9-2-8-28(10-11-29)16-23-14-20-13-18(5-6-24(20)31-23)19-7-12-32-17-19;/h1,3-7,12-15,17H,2,8-11,16H2,(H,27,30);1H