3-[4-azanyl-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]-6-bromanyl-2-phenyl-quinazolin-4-one

Systemtic Name: 3-[4-azanyl-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]-6-bromanyl-2-phenyl-quinazolin-4-one Openeye Name: 3-[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]-6-bromo-2-phenyl-quinazolin-4-one CAS Name: 3-[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]-2-pyrimidinyl]-6-bromo-2-phenyl-4-quinazolinone IUPAC Name: 3-[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]-6-bromo-2-phenylquinazolin-4-one Traditional Name: 3-[4-amino-5-(3,4,5-trimethoxybenzyl)pyrimidin-2-yl]-6-bromo-2-phenyl-quinazolin-4-one Formula: C28H24BrN5O4 MolecularWeight: 574.42526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)N3C(=NC4=C(C3=O)C=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)N3C(=NC4=C(C3=O)C=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C28H24BrN5O4/c1-36-22-12-16(13-23(37-2)24(22)38-3)11-18-15-31-28(33-25(18)30)34-26(17-7-5-4-6-8-17)32-21-10-9-19(29)14-20(21)27(34)35/h4-10,12-15H,11H2,1-3H3,(H2,30,31,33)