2-[4-[2-(4-propan-2-ylphenoxy)-1,3-thiazol-5-yl]but-3-yn-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[4-[2-(4-propan-2-ylphenoxy)-1,3-thiazol-5-yl]but-3-yn-2-yl]isoindole-1,3-dione Openeye Name: 2-[3-[2-(4-isopropylphenoxy)thiazol-5-yl]-1-methyl-prop-2-ynyl]isoindoline-1,3-dione CAS Name: 2-[4-[2-(4-propan-2-ylphenoxy)-5-thiazolyl]but-3-yn-2-yl]isoindole-1,3-dione IUPAC Name: 2-[4-[2-(4-propan-2-ylphenoxy)-1,3-thiazol-5-yl]but-3-yn-2-yl]isoindole-1,3-dione Traditional Name: 2-[3-[2-(4-isopropylphenoxy)thiazol-5-yl]-1-methyl-prop-2-ynyl]isoindoline-1,3-quinone Formula: C24H20N2O3S MolecularWeight: 416.4922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC=C(S2)C#CC(C)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC=C(S2)C#CC(C)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H20N2O3S/c1-15(2)17-9-11-18(12-10-17)29-24-25-14-19(30-24)13-8-16(3)26-22(27)20-6-4-5-7-21(20)23(26)28/h4-7,9-12,14-16H,1-3H3