4-[[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]methyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]methyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]methyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[[4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]methyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[4-[(4-aminoquinazolin-2-yl)methyl]piperazino]methyl]-7-hydroxy-8-methyl-coumarin Formula: C24H25N5O3 MolecularWeight: 431.487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CN3CCN(CC3)CC4=NC5=CC=CC=C5C(=N4)N)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CN3CCN(CC3)CC4=NC5=CC=CC=C5C(=N4)N)O

InChI

InChI=1S/C24H25N5O3/c1-15-20(30)7-6-17-16(12-22(31)32-23(15)17)13-28-8-10-29(11-9-28)14-21-26-19-5-3-2-4-18(19)24(25)27-21/h2-7,12,30H,8-11,13-14H2,1H3,(H2,25,26,27)