N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-4-pentoxy-benzamide

Systemtic Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[[2-(3,4-dimethylphenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[[2-(3,4-dimethylphenoxy)propanoylamino]thiocarbamoyl]benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=CC(=C(C=C2)C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C24H31N3O4S/c1-5-6-7-14-30-20-12-9-19(10-13-20)23(29)25-24(32)27-26-22(28)18(4)31-21-11-8-16(2)17(3)15-21/h8-13,15,18H,5-7,14H2,1-4H3,(H,26,28)(H2,25,27,29,32)