1-[4-(5-bromanylfuran-2-yl)carbonylpiperazin-1-yl]-2-[(2E)-2-(1,2-dihydro-1,2,3,4-tetrazol-5-ylidene)-4-fluoranyl-7-methyl-indol-3-yl]ethane-1,2-dione

Systemtic Name: 1-[4-(5-bromanylfuran-2-yl)carbonylpiperazin-1-yl]-2-[(2E)-2-(1,2-dihydro-1,2,3,4-tetrazol-5-ylidene)-4-fluoranyl-7-methyl-indol-3-yl]ethane-1,2-dione Openeye Name: 1-[4-(5-bromofuran-2-carbonyl)piperazin-1-yl]-2-[(2E)-2-(1,2-dihydrotetrazol-5-ylidene)-4-fluoro-7-methyl-indol-3-yl]ethane-1,2-dione CAS Name: 1-[4-[(5-bromo-2-furanyl)-oxomethyl]-1-piperazinyl]-2-[(2E)-2-(1,2-dihydrotetrazol-5-ylidene)-4-fluoro-7-methyl-3-indolyl]ethane-1,2-dione IUPAC Name: 1-[4-(5-bromofuran-2-carbonyl)piperazin-1-yl]-2-[(2E)-2-(1,2-dihydrotetrazol-5-ylidene)-4-fluoro-7-methylindol-3-yl]ethane-1,2-dione Traditional Name: 1-[4-(5-bromo-2-furoyl)piperazino]-2-[(2E)-2-(1,2-dihydrotetrazol-5-ylidene)-4-fluoro-7-methyl-indol-3-yl]ethane-1,2-dione Formula: C21H17BrFN7O4 MolecularWeight: 530.306583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C2=C(C(=C3NNN=N3)N=C12)C(=O)C(=O)N4CCN(CC4)C(=O)C5=CC=C(O5)Br)F

Isomeric SMILES

CC1=CC=C(C2=C(/C(=C\3/NNN=N3)/N=C12)C(=O)C(=O)N4CCN(CC4)C(=O)C5=CC=C(O5)Br)F

InChI

InChI=1S/C21H17BrFN7O4/c1-10-2-3-11(23)14-15(17(24-16(10)14)19-25-27-28-26-19)18(31)21(33)30-8-6-29(7-9-30)20(32)12-4-5-13(22)34-12/h2-5H,6-9H2,1H3,(H,25,28)(H,26,27)