5-bromanyl-N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]furan-2-carboxamide CAS Name: 5-bromo-N-[3-chloro-4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[3-chloro-4-(4-o-toluoylpiperazino)phenyl]-2-furamide Formula: C23H21BrClN3O3 MolecularWeight: 502.78814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=C(O4)Br)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=C(O4)Br)Cl

InChI

InChI=1S/C23H21BrClN3O3/c1-15-4-2-3-5-17(15)23(30)28-12-10-27(11-13-28)19-7-6-16(14-18(19)25)26-22(29)20-8-9-21(24)31-20/h2-9,14H,10-13H2,1H3,(H,26,29)