5-[[5-(3-phenylmethoxypropyl)-1H-pyrazol-3-yl]amino]quinazolino[2,1-b]quinazolin-12-one

Systemtic Name: 5-[[5-(3-phenylmethoxypropyl)-1H-pyrazol-3-yl]amino]quinazolino[2,1-b]quinazolin-12-one Openeye Name: 5-[[5-(3-benzyloxypropyl)-1H-pyrazol-3-yl]amino]quinazolino[2,1-b]quinazolin-12-one CAS Name: 5-[[5-(3-phenylmethoxypropyl)-1H-pyrazol-3-yl]amino]-12-quinazolino[2,1-b]quinazolinone IUPAC Name: 5-[[5-(3-phenylmethoxypropyl)-1H-pyrazol-3-yl]amino]quinazolino[2,1-b]quinazolin-12-one Traditional Name: 5-[[5-(3-benzoxypropyl)-1H-pyrazol-3-yl]amino]quinazolino[2,1-b]quinazolin-12-one Formula: C28H24N6O2 MolecularWeight: 476.52916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCC2=CC(=NN2)NC3=NC4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C63

Isomeric SMILES

C1=CC=C(C=C1)COCCCC2=CC(=NN2)NC3=NC4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C63

InChI

InChI=1S/C28H24N6O2/c35-27-21-12-4-6-14-23(21)29-28-31-26(22-13-5-7-15-24(22)34(27)28)30-25-17-20(32-33-25)11-8-16-36-18-19-9-2-1-3-10-19/h1-7,9-10,12-15,17H,8,11,16,18H2,(H2,29,30,31,32,33)