6-bromanyl-3-(2-methoxyphenyl)-2-[2-oxidanylidene-3-[5-phenyl-3-(2-phenyl-1H-indol-3-yl)-3,4-dihydropyrazol-2-yl]propyl]quinazolin-4-one

Systemtic Name: 6-bromanyl-3-(2-methoxyphenyl)-2-[2-oxidanylidene-3-[5-phenyl-3-(2-phenyl-1H-indol-3-yl)-3,4-dihydropyrazol-2-yl]propyl]quinazolin-4-one Openeye Name: 6-bromo-3-(2-methoxyphenyl)-2-[2-oxo-3-[5-phenyl-3-(2-phenyl-1H-indol-3-yl)-3,4-dihydropyrazol-2-yl]propyl]quinazolin-4-one CAS Name: 6-bromo-3-(2-methoxyphenyl)-2-[2-oxo-3-[5-phenyl-3-(2-phenyl-1H-indol-3-yl)-3,4-dihydropyrazol-2-yl]propyl]-4-quinazolinone IUPAC Name: 6-bromo-3-(2-methoxyphenyl)-2-[2-oxo-3-[5-phenyl-3-(2-phenyl-1H-indol-3-yl)-3,4-dihydropyrazol-2-yl]propyl]quinazolin-4-one Traditional Name: 6-bromo-2-[2-keto-3-[3-phenyl-5-(2-phenyl-1H-indol-3-yl)-2-pyrazolin-1-yl]propyl]-3-(2-methoxyphenyl)quinazolin-4-one Formula: C41H32BrN5O3 MolecularWeight: 722.62848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)Br)CC(=O)CN4C(CC(=N4)C5=CC=CC=C5)C6=C(NC7=CC=CC=C76)C8=CC=CC=C8

Isomeric SMILES

COC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)Br)CC(=O)CN4C(CC(=N4)C5=CC=CC=C5)C6=C(NC7=CC=CC=C76)C8=CC=CC=C8

InChI

InChI=1S/C41H32BrN5O3/c1-50-37-19-11-10-18-35(37)47-38(43-33-21-20-28(42)22-31(33)41(47)49)23-29(48)25-46-36(24-34(45-46)26-12-4-2-5-13-26)39-30-16-8-9-17-32(30)44-40(39)27-14-6-3-7-15-27/h2-22,36,44H,23-25H2,1H3