N-[[2-(2-chloranyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2-(4-propan-2-ylphenoxy)ethanamide

Systemtic Name: N-[[2-(2-chloranyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2-(4-propan-2-ylphenoxy)ethanamide Openeye Name: N-[[2-(2-chloro-5-iodo-phenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2-(4-isopropylphenoxy)acetamide CAS Name: N-[[[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-2-(4-propan-2-ylphenoxy)acetamide IUPAC Name: N-[[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2-(4-propan-2-ylphenoxy)acetamide Traditional Name: N-[[2-(2-chloro-5-iodo-phenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]-2-(4-isopropylphenoxy)acetamide Formula: C25H21ClIN3O3S MolecularWeight: 605.87501

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)I)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)I)Cl

InChI

InChI=1S/C25H21ClIN3O3S/c1-14(2)15-3-7-18(8-4-15)32-13-23(31)30-25(34)28-17-6-10-22-21(12-17)29-24(33-22)19-11-16(27)5-9-20(19)26/h3-12,14H,13H2,1-2H3,(H2,28,30,31,34)