4-hexoxy-N-[[2-(4-propan-2-ylphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 4-hexoxy-N-[[2-(4-propan-2-ylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 4-hexoxy-N-[[[2-(4-isopropylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 4-hexoxy-N-[[[1-oxo-2-(4-propan-2-ylphenoxy)ethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-hexoxy-N-[[[2-(4-propan-2-ylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 4-hexoxy-N-[[[2-(4-isopropylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C25H33N3O4S/c1-4-5-6-7-16-31-21-14-10-20(11-15-21)24(30)26-25(33)28-27-23(29)17-32-22-12-8-19(9-13-22)18(2)3/h8-15,18H,4-7,16-17H2,1-3H3,(H,27,29)(H2,26,28,30,33)