N-[[2-(2,6-dimethylphenoxy)ethanoylamino]carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[[2-(2,6-dimethylphenoxy)ethanoylamino]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]carbamothioyl]-3-methyl-butanamide CAS Name: N-[[[2-(2,6-dimethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]carbamothioyl]-3-methylbutanamide Traditional Name: N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]thiocarbamoyl]-3-methyl-butyramide Formula: C16H23N3O3S MolecularWeight: 337.43712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O3S/c1-10(2)8-13(20)17-16(23)19-18-14(21)9-22-15-11(3)6-5-7-12(15)4/h5-7,10H,8-9H2,1-4H3,(H,18,21)(H2,17,19,20,23)