2-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]-1,3-benzothiazole

Systemtic Name: 2-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]-1,3-benzothiazole Openeye Name: 2-[4-(4-isopropylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]-1,3-benzothiazole CAS Name: 2-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-2-quinazolinyl]-1,3-benzothiazole IUPAC Name: 2-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazolin-2-yl]-1,3-benzothiazole Traditional Name: 2-(4-p-cumenyl-6-propargyloxy-quinazolin-2-yl)-1,3-benzothiazole Formula: C27H21N3OS MolecularWeight: 435.54014

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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)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)OCC#C)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H21N3OS/c1-4-15-31-20-13-14-22-21(16-20)25(19-11-9-18(10-12-19)17(2)3)30-26(28-22)27-29-23-7-5-6-8-24(23)32-27/h1,5-14,16-17H,15H2,2-3H3