6-chloranyl-3-[2-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]quinazolin-4-one

Systemtic Name: 6-chloranyl-3-[2-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 6-chloro-3-[2-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]quinazolin-4-one CAS Name: 6-chloro-3-[2-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]-4-quinazolinone IUPAC Name: 6-chloro-3-[2-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]quinazolin-4-one Traditional Name: 6-chloro-3-[2-keto-2-[(5R)-5-(4-methoxyphenyl)-3-phenyl-2-pyrazolin-1-yl]ethyl]quinazolin-4-one Formula: C26H21ClN4O3 MolecularWeight: 472.92294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CC(=NN2C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C26H21ClN4O3/c1-34-20-10-7-18(8-11-20)24-14-23(17-5-3-2-4-6-17)29-31(24)25(32)15-30-16-28-22-12-9-19(27)13-21(22)26(30)33/h2-13,16,24H,14-15H2,1H3/t24-/m1/s1