3-(2-fluorophenyl)-2-[[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl]-6-nitro-quinazolin-4-one

Systemtic Name: 3-(2-fluorophenyl)-2-[[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl]-6-nitro-quinazolin-4-one Openeye Name: 3-(2-fluorophenyl)-2-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-6-nitro-quinazolin-4-one CAS Name: 3-(2-fluorophenyl)-2-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]methyl]-6-nitro-4-quinazolinone IUPAC Name: 3-(2-fluorophenyl)-2-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-6-nitroquinazolin-4-one Traditional Name: 3-(2-fluorophenyl)-2-[[4-(2-furoyl)piperazino]methyl]-6-nitro-quinazolin-4-one Formula: C24H20FN5O5 MolecularWeight: 477.444503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=CC=CC=C4F)C(=O)C5=CC=CO5

Isomeric SMILES

C1CN(CCN1CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=CC=CC=C4F)C(=O)C5=CC=CO5

InChI

InChI=1S/C24H20FN5O5/c25-18-4-1-2-5-20(18)29-22(26-19-8-7-16(30(33)34)14-17(19)23(29)31)15-27-9-11-28(12-10-27)24(32)21-6-3-13-35-21/h1-8,13-14H,9-12,15H2