N-[[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]-4-isopropyl-benzamide CAS Name: N-[[[2-(2,4-dichlorophenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]thiocarbamoyl]-4-isopropyl-benzamide Formula: C20H21Cl2N3O3S MolecularWeight: 454.37004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C20H21Cl2N3O3S/c1-11(2)13-4-6-14(7-5-13)19(27)23-20(29)25-24-18(26)12(3)28-17-9-8-15(21)10-16(17)22/h4-12H,1-3H3,(H,24,26)(H2,23,25,27,29)