7-chloranyl-2-[[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-methylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-methylamino]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]methyl]-1H-quinazolin-4-one Formula: C22H22ClN5O MolecularWeight: 407.89598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN5O/c1-14-19(15(2)28(26-14)17-7-5-4-6-8-17)12-27(3)13-21-24-20-11-16(23)9-10-18(20)22(29)25-21/h4-11H,12-13H2,1-3H3,(H,24,25,29)