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

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

CCC(C)N1C(=CSC1=NC2=CC=CC(=C2)C)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CCC(C)N1C(=CSC1=NC2=CC=CC(=C2)C)C3=CC4=C(C=C3)OCC(=O)N4

InChI

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