3-bromanyl-N-[[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]carbamothioyl]-4-(3-methylbutoxy)benzamide

Systemtic Name: 3-bromanyl-N-[[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]carbamothioyl]-4-(3-methylbutoxy)benzamide Openeye Name: 3-bromo-N-[[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]carbamothioyl]-4-isopentyloxy-benzamide CAS Name: 3-bromo-N-[[[2-(4-chloro-2-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: 3-bromo-N-[[[2-(4-chloro-2-methylphenoxy)acetyl]amino]carbamothioyl]-4-(3-methylbutoxy)benzamide Traditional Name: 3-bromo-N-[[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]thiocarbamoyl]-4-isoamoxy-benzamide Formula: C22H25BrClN3O4S MolecularWeight: 542.8736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br

InChI

InChI=1S/C22H25BrClN3O4S/c1-13(2)8-9-30-19-6-4-15(11-17(19)23)21(29)25-22(32)27-26-20(28)12-31-18-7-5-16(24)10-14(18)3/h4-7,10-11,13H,8-9,12H2,1-3H3,(H,26,28)(H2,25,27,29,32)