2-[5-azanyl-1-(2-hydroxyethyl)-3-(phenoxymethyl)pyrazol-4-yl]-1H-quinazolin-4-one

Systemtic Name: 2-[5-azanyl-1-(2-hydroxyethyl)-3-(phenoxymethyl)pyrazol-4-yl]-1H-quinazolin-4-one Openeye Name: 2-[5-amino-1-(2-hydroxyethyl)-3-(phenoxymethyl)pyrazol-4-yl]-1H-quinazolin-4-one CAS Name: 2-[5-amino-1-(2-hydroxyethyl)-3-(phenoxymethyl)-4-pyrazolyl]-1H-quinazolin-4-one IUPAC Name: 2-[5-amino-1-(2-hydroxyethyl)-3-(phenoxymethyl)pyrazol-4-yl]-1H-quinazolin-4-one Traditional Name: 2-[5-amino-1-(2-hydroxyethyl)-3-(phenoxymethyl)pyrazol-4-yl]-1H-quinazolin-4-one Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=NN(C(=C2C3=NC(=O)C4=CC=CC=C4N3)N)CCO

Isomeric SMILES

C1=CC=C(C=C1)OCC2=NN(C(=C2C3=NC(=O)C4=CC=CC=C4N3)N)CCO

InChI

InChI=1S/C20H19N5O3/c21-18-17(19-22-15-9-5-4-8-14(15)20(27)23-19)16(24-25(18)10-11-26)12-28-13-6-2-1-3-7-13/h1-9,26H,10-12,21H2,(H,22,23,27)