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

Systemtic Name: 6-[2-(2-methylphenyl)imino-3-propyl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(o-tolylimino)-3-propyl-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(2-methylphenyl)imino-3-propyl-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(2-methylphenyl)imino-3-propyl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(o-tolylimino)-3-propyl-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CSC1=NC2=CC=CC=C2C)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CCCN1C(=CSC1=NC2=CC=CC=C2C)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C21H21N3O2S/c1-3-10-24-18(13-27-21(24)23-16-7-5-4-6-14(16)2)15-8-9-19-17(11-15)22-20(25)12-26-19/h4-9,11,13H,3,10,12H2,1-2H3,(H,22,25)