[4-[(1-methoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)carbamoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [4-[(1-methoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)carbamoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate Openeye Name: [4-[(1-methoxycarbonyl-3-methylsulfanyl-propyl)carbamoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[[[[1-methoxy-4-(methylthio)-1-oxobutan-2-yl]amino]-oxomethyl]amino]-1-pyrazolyl]methyl ester IUPAC Name: [4-[(1-methoxy-4-methylsulfanyl-1-oxobutan-2-yl)carbamoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[[1-carbomethoxy-3-(methylthio)propyl]carbamoylamino]pyrazol-1-yl]methyl ester Formula: C16H26N4O5S MolecularWeight: 386.46644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=C(C=N1)NC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=C(C=N1)NC(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C16H26N4O5S/c1-16(2,3)14(22)25-10-20-9-11(8-17-20)18-15(23)19-12(6-7-26-5)13(21)24-4/h8-9,12H,6-7,10H2,1-5H3,(H2,18,19,23)