ethyl 4-[(2,6-dimethylphenyl)carbamothioylamino]butanoate

Systemtic Name: ethyl 4-[(2,6-dimethylphenyl)carbamothioylamino]butanoate Openeye Name: ethyl 4-[(2,6-dimethylphenyl)carbamothioylamino]butanoate CAS Name: 4-[[(2,6-dimethylanilino)-sulfanylidenemethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(2,6-dimethylphenyl)carbamothioylamino]butanoate Traditional Name: 4-[(2,6-dimethylphenyl)thiocarbamoylamino]butyric acid ethyl ester Formula: C15H22N2O2S MolecularWeight: 294.41238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=S)NC1=C(C=CC=C1C)C

Isomeric SMILES

CCOC(=O)CCCNC(=S)NC1=C(C=CC=C1C)C

InChI

InChI=1S/C15H22N2O2S/c1-4-19-13(18)9-6-10-16-15(20)17-14-11(2)7-5-8-12(14)3/h5,7-8H,4,6,9-10H2,1-3H3,(H2,16,17,20)