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

Systemtic Name: N-[[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-4-heptoxy-benzamide CAS Name: N-[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]hydrazo]-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-4-heptoxybenzamide Traditional Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]thiocarbamoyl]-4-heptoxy-benzamide Formula: C25H31Cl2N3O4S MolecularWeight: 540.50234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C25H31Cl2N3O4S/c1-2-3-4-5-6-15-33-20-12-9-18(10-13-20)24(32)28-25(35)30-29-23(31)8-7-16-34-22-14-11-19(26)17-21(22)27/h9-14,17H,2-8,15-16H2,1H3,(H,29,31)(H2,28,30,32,35)