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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCC(C)C

InChI

InChI=1S/C21H25N3O4S/c1-14(2)12-27-18-9-5-7-16(11-18)20(26)22-21(29)24-23-19(25)13-28-17-8-4-6-15(3)10-17/h4-11,14H,12-13H2,1-3H3,(H,23,25)(H2,22,24,26,29)