methyl 4-[(4-methylsulfanylphenyl)carbamoylamino]butanoate

Systemtic Name: methyl 4-[(4-methylsulfanylphenyl)carbamoylamino]butanoate Openeye Name: methyl 4-[(4-methylsulfanylphenyl)carbamoylamino]butanoate CAS Name: 4-[[[4-(methylthio)anilino]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(4-methylsulfanylphenyl)carbamoylamino]butanoate Traditional Name: 4-[[4-(methylthio)phenyl]carbamoylamino]butyric acid methyl ester Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)NC1=CC=C(C=C1)SC

Isomeric SMILES

COC(=O)CCCNC(=O)NC1=CC=C(C=C1)SC

InChI

InChI=1S/C13H18N2O3S/c1-18-12(16)4-3-9-14-13(17)15-10-5-7-11(19-2)8-6-10/h5-8H,3-4,9H2,1-2H3,(H2,14,15,17)