N-[[2-(4-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-3-methyl-benzamide

Systemtic Name: N-[[2-(4-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-3-methyl-benzamide Openeye Name: 3-methyl-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: N-[[[2-(4-butan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-methylbenzamide IUPAC Name: N-[[[2-(4-butan-2-ylphenoxy)acetyl]amino]carbamothioyl]-3-methylbenzamide Traditional Name: 3-methyl-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C21H25N3O3S/c1-4-15(3)16-8-10-18(11-9-16)27-13-19(25)23-24-21(28)22-20(26)17-7-5-6-14(2)12-17/h5-12,15H,4,13H2,1-3H3,(H,23,25)(H2,22,24,26,28)