2-[2-[2-[(3-phenylmethoxypyridin-2-yl)amino]-1,3-thiazol-4-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[2-[(3-phenylmethoxypyridin-2-yl)amino]-1,3-thiazol-4-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-[(3-benzyloxy-2-pyridyl)amino]thiazol-4-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-[(3-phenylmethoxy-2-pyridinyl)amino]-4-thiazolyl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-[(3-phenylmethoxypyridin-2-yl)amino]-1,3-thiazol-4-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[2-[(3-benzoxy-2-pyridyl)amino]thiazol-4-yl]ethyl]isoindoline-1,3-quinone Formula: C25H20N4O3S MolecularWeight: 456.5163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(N=CC=C2)NC3=NC(=CS3)CCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(N=CC=C2)NC3=NC(=CS3)CCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H20N4O3S/c30-23-19-9-4-5-10-20(19)24(31)29(23)14-12-18-16-33-25(27-18)28-22-21(11-6-13-26-22)32-15-17-7-2-1-3-8-17/h1-11,13,16H,12,14-15H2,(H,26,27,28)