2-(5-fluoranyl-1-methyl-benzimidazol-2-yl)-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazoline

Systemtic Name: 2-(5-fluoranyl-1-methyl-benzimidazol-2-yl)-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazoline Openeye Name: 2-(5-fluoro-1-methyl-benzimidazol-2-yl)-4-(4-isopropylphenyl)-6-prop-2-ynoxy-quinazoline CAS Name: 2-(5-fluoro-1-methyl-2-benzimidazolyl)-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazoline IUPAC Name: 2-(5-fluoro-1-methylbenzimidazol-2-yl)-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazoline Traditional Name: 2-(5-fluoro-1-methyl-benzimidazol-2-yl)-4-p-cumenyl-6-propargyloxy-quinazoline Formula: C28H23FN4O MolecularWeight: 450.506823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)OCC#C)C4=NC5=C(N4C)C=CC(=C5)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)OCC#C)C4=NC5=C(N4C)C=CC(=C5)F

InChI

InChI=1S/C28H23FN4O/c1-5-14-34-21-11-12-23-22(16-21)26(19-8-6-18(7-9-19)17(2)3)32-27(30-23)28-31-24-15-20(29)10-13-25(24)33(28)4/h1,6-13,15-17H,14H2,2-4H3