piperidin-1-yl-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]methanone

Systemtic Name: piperidin-1-yl-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]methanone Openeye Name: [4-(4-isopropylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]-(1-piperidyl)methanone CAS Name: 1-piperidinyl-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-2-quinazolinyl]methanone IUPAC Name: piperidin-1-yl-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazolin-2-yl]methanone Traditional Name: (4-p-cumenyl-6-propargyloxy-quinazolin-2-yl)-piperidino-methanone Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)OCC#C)C(=O)N4CCCCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)OCC#C)C(=O)N4CCCCC4

InChI

InChI=1S/C26H27N3O2/c1-4-16-31-21-12-13-23-22(17-21)24(20-10-8-19(9-11-20)18(2)3)28-25(27-23)26(30)29-14-6-5-7-15-29/h1,8-13,17-18H,5-7,14-16H2,2-3H3