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

Systemtic Name: 6-[2-(4-chlorophenyl)imino-3-pentan-3-yl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(4-chlorophenyl)imino-3-(1-ethylpropyl)thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(4-chlorophenyl)imino-3-pentan-3-yl-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(4-chlorophenyl)imino-3-pentan-3-yl-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(4-chlorophenyl)imino-3-(1-ethylpropyl)-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C22H22ClN3O2S MolecularWeight: 427.94698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClN3O2S/c1-3-17(4-2)26-19(13-29-22(26)24-16-8-6-15(23)7-9-16)14-5-10-20-18(11-14)25-21(27)12-28-20/h5-11,13,17H,3-4,12H2,1-2H3,(H,25,27)