4-(4-fluorophenyl)-7,7-dimethyl-2-pyridin-3-yl-1,4,6,8-tetrahydroquinazolin-5-one

Systemtic Name: 4-(4-fluorophenyl)-7,7-dimethyl-2-pyridin-3-yl-1,4,6,8-tetrahydroquinazolin-5-one Openeye Name: 4-(4-fluorophenyl)-7,7-dimethyl-2-(3-pyridyl)-1,4,6,8-tetrahydroquinazolin-5-one CAS Name: 4-(4-fluorophenyl)-7,7-dimethyl-2-(3-pyridinyl)-1,4,6,8-tetrahydroquinazolin-5-one IUPAC Name: 4-(4-fluorophenyl)-7,7-dimethyl-2-pyridin-3-yl-1,4,6,8-tetrahydroquinazolin-5-one Traditional Name: 4-(4-fluorophenyl)-7,7-dimethyl-2-(3-pyridyl)-1,4,6,8-tetrahydroquinazolin-5-one Formula: C21H20FN3O MolecularWeight: 349.401403

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(N=C(N2)C3=CN=CC=C3)C4=CC=C(C=C4)F)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(N=C(N2)C3=CN=CC=C3)C4=CC=C(C=C4)F)C(=O)C1)C

InChI

InChI=1S/C21H20FN3O/c1-21(2)10-16-18(17(26)11-21)19(13-5-7-15(22)8-6-13)25-20(24-16)14-4-3-9-23-12-14/h3-9,12,19H,10-11H2,1-2H3,(H,24,25)