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

Systemtic Name: 6-[3-butyl-2-(3,4-dimethylphenyl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-butyl-2-(3,4-dimethylphenyl)imino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-butyl-2-(3,4-dimethylphenyl)imino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-butyl-2-(3,4-dimethylphenyl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-butyl-2-(3,4-dimethylphenyl)imino-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:

CCCCN1C(=CSC1=NC2=CC(=C(C=C2)C)C)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CCCCN1C(=CSC1=NC2=CC(=C(C=C2)C)C)C3=CC4=C(C=C3)OCC(=O)N4

InChI

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