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

Systemtic Name: 6-[2-(3-methylphenyl)imino-3-pentan-2-yl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(1-methylbutyl)-2-(m-tolylimino)thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(3-methylphenyl)imino-3-pentan-2-yl-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3-methylphenyl)imino-3-pentan-2-yl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(1-methylbutyl)-2-(m-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:

CCCC(C)N1C(=CSC1=NC2=CC=CC(=C2)C)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CCCC(C)N1C(=CSC1=NC2=CC=CC(=C2)C)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C23H25N3O2S/c1-4-6-16(3)26-20(14-29-23(26)24-18-8-5-7-15(2)11-18)17-9-10-21-19(12-17)25-22(27)13-28-21/h5,7-12,14,16H,4,6,13H2,1-3H3,(H,25,27)