6-[2-(2-methylphenyl)imino-3-pentan-3-yl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(2-methylphenyl)imino-3-pentan-3-yl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(1-ethylpropyl)-2-(o-tolylimino)thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(2-methylphenyl)imino-3-pentan-3-yl-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(2-methylphenyl)imino-3-pentan-3-yl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(1-ethylpropyl)-2-(o-tolylimino)-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C(=CSC1=NC2=CC=CC=C2C)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CCC(CC)N1C(=CSC1=NC2=CC=CC=C2C)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C23H25N3O2S/c1-4-17(5-2)26-20(14-29-23(26)25-18-9-7-6-8-15(18)3)16-10-11-21-19(12-16)24-22(27)13-28-21/h6-12,14,17H,4-5,13H2,1-3H3,(H,24,27)