N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-3-methyl-benzamide

Systemtic Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-3-methyl-benzamide Openeye Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-3-methyl-benzamide CAS Name: N-[[[2-(3,4-dimethylphenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]-3-methylbenzamide IUPAC Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-3-methylbenzamide Traditional Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]thiocarbamoyl]-3-methyl-benzamide Formula: C20H23N3O3S MolecularWeight: 385.47992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O3S/c1-12-6-5-7-16(10-12)19(25)21-20(27)23-22-18(24)15(4)26-17-9-8-13(2)14(3)11-17/h5-11,15H,1-4H3,(H,22,24)(H2,21,23,25,27)