N-[[2-(2,3-dimethylphenoxy)ethanoylamino]carbamothioyl]-4-hexoxy-benzamide

Systemtic Name: N-[[2-(2,3-dimethylphenoxy)ethanoylamino]carbamothioyl]-4-hexoxy-benzamide Openeye Name: N-[[[2-(2,3-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-hexoxy-benzamide CAS Name: N-[[[2-(2,3-dimethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-hexoxybenzamide IUPAC Name: N-[[[2-(2,3-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-hexoxybenzamide Traditional Name: N-[[[2-(2,3-dimethylphenoxy)acetyl]amino]thiocarbamoyl]-4-hexoxy-benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC(=C2C)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC(=C2C)C

InChI

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