[4-(4-tert-butylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]-(4-methoxyphenyl)methanone

Systemtic Name: [4-(4-tert-butylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]-(4-methoxyphenyl)methanone Openeye Name: [4-(4-tert-butylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]-(4-methoxyphenyl)methanone CAS Name: [4-(4-tert-butylphenyl)-6-prop-2-ynoxy-2-quinazolinyl]-(4-methoxyphenyl)methanone IUPAC Name: [4-(4-tert-butylphenyl)-6-prop-2-ynoxyquinazolin-2-yl]-(4-methoxyphenyl)methanone Traditional Name: [4-(4-tert-butylphenyl)-6-propargyloxy-quinazolin-2-yl]-(4-methoxyphenyl)methanone Formula: C29H26N2O3 MolecularWeight: 450.52834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)OCC#C)C(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)OCC#C)C(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C29H26N2O3/c1-6-17-34-23-15-16-25-24(18-23)26(19-7-11-21(12-8-19)29(2,3)4)31-28(30-25)27(32)20-9-13-22(33-5)14-10-20/h1,7-16,18H,17H2,2-5H3