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

Systemtic Name: N-[[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]hydrazo]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[[4-(2,4-dichlorophenoxy)butanoylamino]thiocarbamoyl]benzamide Formula: C23H27Cl2N3O4S MolecularWeight: 512.44918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C23H27Cl2N3O4S/c1-2-3-4-13-31-18-10-7-16(8-11-18)22(30)26-23(33)28-27-21(29)6-5-14-32-20-12-9-17(24)15-19(20)25/h7-12,15H,2-6,13-14H2,1H3,(H,27,29)(H2,26,28,30,33)