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

Systemtic Name: 4-butoxy-N-[[2-(3-methylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[[[2-(3-methylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[[2-(3-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[[[2-(3-methylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[[[2-(3-methylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC(=C2)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC(=C2)C

InChI

InChI=1S/C21H25N3O4S/c1-3-4-12-27-17-10-8-16(9-11-17)20(26)22-21(29)24-23-19(25)14-28-18-7-5-6-15(2)13-18/h5-11,13H,3-4,12,14H2,1-2H3,(H,23,25)(H2,22,24,26,29)