4-(3-methylbutoxy)-N-[[2-(2-methylphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 4-(3-methylbutoxy)-N-[[2-(2-methylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 4-isopentyloxy-N-[[[2-(2-methylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 4-(3-methylbutoxy)-N-[[[2-(2-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-(3-methylbutoxy)-N-[[[2-(2-methylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 4-isoamoxy-N-[[[2-(2-methylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)OCCC(C)C

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)OCCC(C)C

InChI

InChI=1S/C22H27N3O4S/c1-15(2)12-13-28-18-10-8-17(9-11-18)21(27)23-22(30)25-24-20(26)14-29-19-7-5-4-6-16(19)3/h4-11,15H,12-14H2,1-3H3,(H,24,26)(H2,23,25,27,30)