2-[[4-(1H-indazol-3-ylcarbonyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(1H-indazol-3-ylcarbonyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-(1H-indazole-3-carbonyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-[1H-indazol-3-yl(oxo)methyl]-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-(1H-indazole-3-carbonyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[4-(1H-indazole-3-carbonyl)piperazino]methyl]-1H-quinazolin-4-one Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=O)C3=CC=CC=C3N2)C(=O)C4=NNC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CC2=NC(=O)C3=CC=CC=C3N2)C(=O)C4=NNC5=CC=CC=C54

InChI

InChI=1S/C21H20N6O2/c28-20-15-6-2-3-7-16(15)22-18(23-20)13-26-9-11-27(12-10-26)21(29)19-14-5-1-4-8-17(14)24-25-19/h1-8H,9-13H2,(H,24,25)(H,22,23,28)