3-azanyl-1-[4-(6-bromanyl-4-phenyl-quinazolin-2-yl)piperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one

Systemtic Name: 3-azanyl-1-[4-(6-bromanyl-4-phenyl-quinazolin-2-yl)piperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one Openeye Name: 3-amino-1-[4-(6-bromo-4-phenyl-quinazolin-2-yl)piperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one CAS Name: 3-amino-1-[4-(6-bromo-4-phenyl-2-quinazolinyl)-1-piperazinyl]-3-(3,4-dimethoxyphenyl)-1-propanone IUPAC Name: 3-amino-1-[4-(6-bromo-4-phenylquinazolin-2-yl)piperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one Traditional Name: 3-amino-1-[4-(6-bromo-4-phenyl-quinazolin-2-yl)piperazino]-3-(3,4-dimethoxyphenyl)propan-1-one Formula: C29H30BrN5O3 MolecularWeight: 576.4842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)N2CCN(CC2)C3=NC4=C(C=C(C=C4)Br)C(=N3)C5=CC=CC=C5)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)N2CCN(CC2)C3=NC4=C(C=C(C=C4)Br)C(=N3)C5=CC=CC=C5)N)OC

InChI

InChI=1S/C29H30BrN5O3/c1-37-25-11-8-20(16-26(25)38-2)23(31)18-27(36)34-12-14-35(15-13-34)29-32-24-10-9-21(30)17-22(24)28(33-29)19-6-4-3-5-7-19/h3-11,16-17,23H,12-15,18,31H2,1-2H3