N-[[2-(4-methoxyphenyl)ethanoylamino]carbamothioyl]-2-pentoxy-benzamide

Systemtic Name: N-[[2-(4-methoxyphenyl)ethanoylamino]carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[[[2-(4-methoxyphenyl)acetyl]amino]carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[[2-(4-methoxyphenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[[2-(4-methoxyphenyl)acetyl]amino]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[[[2-(4-methoxyphenyl)acetyl]amino]thiocarbamoyl]benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C22H27N3O4S/c1-3-4-7-14-29-19-9-6-5-8-18(19)21(27)23-22(30)25-24-20(26)15-16-10-12-17(28-2)13-11-16/h5-6,8-13H,3-4,7,14-15H2,1-2H3,(H,24,26)(H2,23,25,27,30)