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

Systemtic Name: 6-bromanyl-2-[3-[3-(1H-indol-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-propyl]-3-(2-methoxyphenyl)quinazolin-4-one Openeye Name: 6-bromo-2-[3-[3-(1H-indol-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxo-propyl]-3-(2-methoxyphenyl)quinazolin-4-one CAS Name: 6-bromo-2-[3-[3-(1H-indol-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxopropyl]-3-(2-methoxyphenyl)-4-quinazolinone IUPAC Name: 6-bromo-2-[3-[3-(1H-indol-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxopropyl]-3-(2-methoxyphenyl)quinazolin-4-one Traditional Name: 6-bromo-2-[3-[5-(1H-indol-3-yl)-3-phenyl-2-pyrazolin-1-yl]-2-keto-propyl]-3-(2-methoxyphenyl)quinazolin-4-one Formula: C35H28BrN5O3 MolecularWeight: 646.53252

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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=CNC7=CC=CC=C76

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=CNC7=CC=CC=C76

InChI

InChI=1S/C35H28BrN5O3/c1-44-33-14-8-7-13-31(33)41-34(38-29-16-15-23(36)17-26(29)35(41)43)18-24(42)21-40-32(19-30(39-40)22-9-3-2-4-10-22)27-20-37-28-12-6-5-11-25(27)28/h2-17,20,32,37H,18-19,21H2,1H3