[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-(5-bromanyl-3-methyl-1-benzofuran-2-yl)methanone

Systemtic Name: [4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-(5-bromanyl-3-methyl-1-benzofuran-2-yl)methanone Openeye Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(5-bromo-3-methyl-benzofuran-2-yl)methanone CAS Name: [4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-(5-bromo-3-methyl-2-benzofuranyl)methanone IUPAC Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(5-bromo-3-methyl-1-benzofuran-2-yl)methanone Traditional Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazino]-(5-bromo-3-methyl-benzofuran-2-yl)methanone Formula: C23H22BrN5O2 MolecularWeight: 480.35708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)N3CCN(CC3)CC4=NC5=CC=CC=C5C(=N4)N

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)N3CCN(CC3)CC4=NC5=CC=CC=C5C(=N4)N

InChI

InChI=1S/C23H22BrN5O2/c1-14-17-12-15(24)6-7-19(17)31-21(14)23(30)29-10-8-28(9-11-29)13-20-26-18-5-3-2-4-16(18)22(25)27-20/h2-7,12H,8-11,13H2,1H3,(H2,25,26,27)