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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=CC=C(O4)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=CC=C(O4)Br

InChI

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