5-bromanyl-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-bromanyl-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-1-benzofuran-2-carboxamide Openeye Name: 5-bromo-N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]benzofuran-2-carboxamide CAS Name: 5-bromo-N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-2-benzofurancarboxamide IUPAC Name: 5-bromo-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-1-benzofuran-2-carboxamide Traditional Name: 5-bromo-N-[3-[4-(m-tolyl)piperazino]propyl]coumarilamide Formula: C23H26BrN3O2 MolecularWeight: 456.37544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C3=CC4=C(O3)C=CC(=C4)Br

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C3=CC4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C23H26BrN3O2/c1-17-4-2-5-20(14-17)27-12-10-26(11-13-27)9-3-8-25-23(28)22-16-18-15-19(24)6-7-21(18)29-22/h2,4-7,14-16H,3,8-13H2,1H3,(H,25,28)