methyl 4-[(cyclohexylcarbonylamino)carbamothioylamino]butanoate

Systemtic Name: methyl 4-[(cyclohexylcarbonylamino)carbamothioylamino]butanoate Openeye Name: methyl 4-[(cyclohexanecarbonylamino)carbamothioylamino]butanoate CAS Name: 4-[[[[cyclohexyl(oxo)methyl]hydrazo]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(cyclohexanecarbonylamino)carbamothioylamino]butanoate Traditional Name: 4-[(cyclohexanecarbonylamino)thiocarbamoylamino]butyric acid methyl ester Formula: C13H23N3O3S MolecularWeight: 301.40502

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=S)NNC(=O)C1CCCCC1

Isomeric SMILES

COC(=O)CCCNC(=S)NNC(=O)C1CCCCC1

InChI

InChI=1S/C13H23N3O3S/c1-19-11(17)8-5-9-14-13(20)16-15-12(18)10-6-3-2-4-7-10/h10H,2-9H2,1H3,(H,15,18)(H2,14,16,20)