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

Systemtic Name: N-[[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]-4-heptoxy-benzamide CAS Name: N-[[[2-(2,4-dichlorophenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]-4-heptoxybenzamide Traditional Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]thiocarbamoyl]-4-heptoxy-benzamide Formula: C24H29Cl2N3O4S MolecularWeight: 526.47576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C24H29Cl2N3O4S/c1-3-4-5-6-7-14-32-19-11-8-17(9-12-19)23(31)27-24(34)29-28-22(30)16(2)33-21-13-10-18(25)15-20(21)26/h8-13,15-16H,3-7,14H2,1-2H3,(H,28,30)(H2,27,29,31,34)