5-bromanyl-N-[3-methyl-2-(4-prop-2-enylpiperazin-1-yl)phenyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[3-methyl-2-(4-prop-2-enylpiperazin-1-yl)phenyl]furan-2-carboxamide Openeye Name: N-[2-(4-allylpiperazin-1-yl)-3-methyl-phenyl]-5-bromo-furan-2-carboxamide CAS Name: 5-bromo-N-[3-methyl-2-(4-prop-2-enyl-1-piperazinyl)phenyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[3-methyl-2-(4-prop-2-enylpiperazin-1-yl)phenyl]furan-2-carboxamide Traditional Name: N-[2-(4-allylpiperazino)-3-methyl-phenyl]-5-bromo-2-furamide Formula: C19H22BrN3O2 MolecularWeight: 404.30088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(O2)Br)N3CCN(CC3)CC=C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(O2)Br)N3CCN(CC3)CC=C

InChI

InChI=1S/C19H22BrN3O2/c1-3-9-22-10-12-23(13-11-22)18-14(2)5-4-6-15(18)21-19(24)16-7-8-17(20)25-16/h3-8H,1,9-13H2,2H3,(H,21,24)