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

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

CC1=CC=CC=C1N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)CC(C)C

Isomeric SMILES

CC1=CC=CC=C1N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)CC(C)C

InChI

InChI=1S/C22H23N3O2S/c1-14(2)11-25-19(13-28-22(25)24-17-7-5-4-6-15(17)3)16-8-9-20-18(10-16)23-21(26)12-27-20/h4-10,13-14H,11-12H2,1-3H3,(H,23,26)