N-[[2-(3,5-dimethylphenoxy)ethanoylamino]carbamothioyl]-4-phenethyloxy-benzamide

Systemtic Name: N-[[2-(3,5-dimethylphenoxy)ethanoylamino]carbamothioyl]-4-phenethyloxy-benzamide Openeye Name: N-[[[2-(3,5-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-phenethyloxy-benzamide CAS Name: N-[[[2-(3,5-dimethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: N-[[[2-(3,5-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-phenethyloxybenzamide Traditional Name: N-[[[2-(3,5-dimethylphenoxy)acetyl]amino]thiocarbamoyl]-4-phenethyloxy-benzamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)OCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)OCCC3=CC=CC=C3)C

InChI

InChI=1S/C26H27N3O4S/c1-18-14-19(2)16-23(15-18)33-17-24(30)28-29-26(34)27-25(31)21-8-10-22(11-9-21)32-13-12-20-6-4-3-5-7-20/h3-11,14-16H,12-13,17H2,1-2H3,(H,28,30)(H2,27,29,31,34)