methyl 4-(cyclobutylcarbamothioylamino)benzoate

Systemtic Name: methyl 4-(cyclobutylcarbamothioylamino)benzoate Openeye Name: methyl 4-(cyclobutylcarbamothioylamino)benzoate CAS Name: 4-[[(cyclobutylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(cyclobutylcarbamothioylamino)benzoate Traditional Name: 4-(cyclobutylthiocarbamoylamino)benzoic acid methyl ester Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=S)NC2CCC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)NC2CCC2

InChI

InChI=1S/C13H16N2O2S/c1-17-12(16)9-5-7-11(8-6-9)15-13(18)14-10-3-2-4-10/h5-8,10H,2-4H2,1H3,(H2,14,15,18)