2-(4-chloranyl-2-methyl-phenoxy)-N-[[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-chloranyl-2-methyl-phenoxy)-N-[[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]ethanamide Openeye Name: 2-(4-chloro-2-methyl-phenoxy)-N-[[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]acetamide CAS Name: 2-(4-chloro-2-methylphenoxy)-N-[[[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chloro-2-methylphenoxy)-N-[[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]acetamide Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-N-[[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]acetamide Formula: C25H22ClN3O3S MolecularWeight: 479.97848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)COC4=C(C=C(C=C4)Cl)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)COC4=C(C=C(C=C4)Cl)C

InChI

InChI=1S/C25H22ClN3O3S/c1-3-16-4-6-17(7-5-16)24-28-20-13-19(9-11-22(20)32-24)27-25(33)29-23(30)14-31-21-10-8-18(26)12-15(21)2/h4-13H,3,14H2,1-2H3,(H2,27,29,30,33)