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

Systemtic Name: 2-[(2S)-4-[2-(4-propan-2-yloxyphenoxy)-1,3-thiazol-5-yl]but-3-yn-2-yl]isoindole-1,3-dione Openeye Name: 2-[(1S)-3-[2-(4-isopropoxyphenoxy)thiazol-5-yl]-1-methyl-prop-2-ynyl]isoindoline-1,3-dione CAS Name: 2-[(2S)-4-[2-(4-propan-2-yloxyphenoxy)-5-thiazolyl]but-3-yn-2-yl]isoindole-1,3-dione IUPAC Name: 2-[(2S)-4-[2-(4-propan-2-yloxyphenoxy)-1,3-thiazol-5-yl]but-3-yn-2-yl]isoindole-1,3-dione Traditional Name: 2-[(1S)-3-[2-(4-isopropoxyphenoxy)thiazol-5-yl]-1-methyl-prop-2-ynyl]isoindoline-1,3-quinone Formula: C24H20N2O4S MolecularWeight: 432.4916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)OC2=NC=C(S2)C#CC(C)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C[C@@H](C#CC1=CN=C(S1)OC2=CC=C(C=C2)OC(C)C)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H20N2O4S/c1-15(2)29-17-9-11-18(12-10-17)30-24-25-14-19(31-24)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/t16-/m0/s1