1-[1,6-dimethyl-2-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]benzimidazol-5-yl]butan-1-one

Systemtic Name: 1-[1,6-dimethyl-2-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]benzimidazol-5-yl]butan-1-one Openeye Name: 1-[2-[4-(4-isopropylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]-1,6-dimethyl-benzimidazol-5-yl]butan-1-one CAS Name: 1-[1,6-dimethyl-2-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-2-quinazolinyl]-5-benzimidazolyl]-1-butanone IUPAC Name: 1-[1,6-dimethyl-2-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazolin-2-yl]benzimidazol-5-yl]butan-1-one Traditional Name: 1-[1,6-dimethyl-2-(4-p-cumenyl-6-propargyloxy-quinazolin-2-yl)benzimidazol-5-yl]butan-1-one Formula: C33H32N4O2 MolecularWeight: 516.63278

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1C)N(C(=N2)C3=NC4=C(C=C(C=C4)OCC#C)C(=N3)C5=CC=C(C=C5)C(C)C)C

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1C)N(C(=N2)C3=NC4=C(C=C(C=C4)OCC#C)C(=N3)C5=CC=C(C=C5)C(C)C)C

InChI

InChI=1S/C33H32N4O2/c1-7-9-30(38)25-19-28-29(17-21(25)5)37(6)33(35-28)32-34-27-15-14-24(39-16-8-2)18-26(27)31(36-32)23-12-10-22(11-13-23)20(3)4/h2,10-15,17-20H,7,9,16H2,1,3-6H3