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

Systemtic Name: 6-[3-(2-methoxyethyl)-2-(4-methylphenyl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(2-methoxyethyl)-2-(p-tolylimino)thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(2-methoxyethyl)-2-(4-methylphenyl)imino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(2-methoxyethyl)-2-(4-methylphenyl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(2-methoxyethyl)-2-(p-tolylimino)-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C21H21N3O3S MolecularWeight: 395.47474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O3S/c1-14-3-6-16(7-4-14)22-21-24(9-10-26-2)18(13-28-21)15-5-8-19-17(11-15)23-20(25)12-27-19/h3-8,11,13H,9-10,12H2,1-2H3,(H,23,25)