(4-ethylphenyl)-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]methanone

Systemtic Name: (4-ethylphenyl)-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]methanone Openeye Name: (4-ethylphenyl)-[4-(4-isopropylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]methanone CAS Name: (4-ethylphenyl)-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-2-quinazolinyl]methanone IUPAC Name: (4-ethylphenyl)-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazolin-2-yl]methanone Traditional Name: (4-ethylphenyl)-(4-p-cumenyl-6-propargyloxy-quinazolin-2-yl)methanone Formula: C29H26N2O2 MolecularWeight: 434.52894

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C2=NC3=C(C=C(C=C3)OCC#C)C(=N2)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C2=NC3=C(C=C(C=C3)OCC#C)C(=N2)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C29H26N2O2/c1-5-17-33-24-15-16-26-25(18-24)27(22-13-11-21(12-14-22)19(3)4)31-29(30-26)28(32)23-9-7-20(6-2)8-10-23/h1,7-16,18-19H,6,17H2,2-4H3