6-[2-(4-ethanoylphenyl)imino-3-(2-pyridin-2-ylethyl)-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(4-ethanoylphenyl)imino-3-(2-pyridin-2-ylethyl)-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(4-acetylphenyl)imino-3-[2-(2-pyridyl)ethyl]thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(4-acetylphenyl)imino-3-[2-(2-pyridinyl)ethyl]-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(4-acetylphenyl)imino-3-(2-pyridin-2-ylethyl)-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(4-acetylphenyl)imino-3-[2-(2-pyridyl)ethyl]-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C26H22N4O3S MolecularWeight: 470.54288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)CCC5=CC=CC=N5

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)CCC5=CC=CC=N5

InChI

InChI=1S/C26H22N4O3S/c1-17(31)18-5-8-21(9-6-18)28-26-30(13-11-20-4-2-3-12-27-20)23(16-34-26)19-7-10-24-22(14-19)29-25(32)15-33-24/h2-10,12,14,16H,11,13,15H2,1H3,(H,29,32)