methyl 4-methylsulfanyl-2-[(4-propan-2-ylphenyl)carbamoylamino]butanoate

Systemtic Name: methyl 4-methylsulfanyl-2-[(4-propan-2-ylphenyl)carbamoylamino]butanoate Openeye Name: methyl 2-[(4-isopropylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate CAS Name: 4-(methylthio)-2-[[oxo-(4-propan-2-ylanilino)methyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-methylsulfanyl-2-[(4-propan-2-ylphenyl)carbamoylamino]butanoate Traditional Name: 4-(methylthio)-2-(p-cumenylcarbamoylamino)butyric acid methyl ester Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C16H24N2O3S/c1-11(2)12-5-7-13(8-6-12)17-16(20)18-14(9-10-22-4)15(19)21-3/h5-8,11,14H,9-10H2,1-4H3,(H2,17,18,20)