6-[2-(3,5-dimethylphenyl)imino-3-prop-2-enyl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(3,5-dimethylphenyl)imino-3-prop-2-enyl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-allyl-2-(3,5-dimethylphenyl)imino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(3,5-dimethylphenyl)imino-3-prop-2-enyl-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3,5-dimethylphenyl)imino-3-prop-2-enyl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-allyl-2-(3,5-dimethylphenyl)imino-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)CC=C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)CC=C)C

InChI

InChI=1S/C22H21N3O2S/c1-4-7-25-19(16-5-6-20-18(11-16)24-21(26)12-27-20)13-28-22(25)23-17-9-14(2)8-15(3)10-17/h4-6,8-11,13H,1,7,12H2,2-3H3,(H,24,26)