N-[[2-(2,6-dimethylphenoxy)ethanoylamino]carbamothioyl]-3-phenyl-propanamide

Systemtic Name: N-[[2-(2,6-dimethylphenoxy)ethanoylamino]carbamothioyl]-3-phenyl-propanamide Openeye Name: N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]carbamothioyl]-3-phenyl-propanamide CAS Name: N-[[[2-(2,6-dimethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]carbamothioyl]-3-phenylpropanamide Traditional Name: N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]thiocarbamoyl]-3-phenyl-propionamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C20H23N3O3S/c1-14-7-6-8-15(2)19(14)26-13-18(25)22-23-20(27)21-17(24)12-11-16-9-4-3-5-10-16/h3-10H,11-13H2,1-2H3,(H,22,25)(H2,21,23,24,27)