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

Systemtic Name: 6-[2-(3,4-dimethylphenyl)imino-3-propyl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(3,4-dimethylphenyl)imino-3-propyl-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(3,4-dimethylphenyl)imino-3-propyl-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3,4-dimethylphenyl)imino-3-propyl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(3,4-dimethylphenyl)imino-3-propyl-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CSC1=NC2=CC(=C(C=C2)C)C)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CCCN1C(=CSC1=NC2=CC(=C(C=C2)C)C)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C22H23N3O2S/c1-4-9-25-19(16-6-8-20-18(11-16)24-21(26)12-27-20)13-28-22(25)23-17-7-5-14(2)15(3)10-17/h5-8,10-11,13H,4,9,12H2,1-3H3,(H,24,26)