methyl 2-[[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]carbamoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]carbamoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]carbamoylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[[1-(3-methoxy-3-methylbutyl)-4-pyrazolyl]amino]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[1-(3-methoxy-3-methylbutyl)pyrazol-4-yl]carbamoylamino]-4-methylsulfanylbutanoate Traditional Name: 2-[[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]carbamoylamino]-4-(methylthio)butyric acid methyl ester Formula: C16H28N4O4S MolecularWeight: 372.48292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C=C(C=N1)NC(=O)NC(CCSC)C(=O)OC)OC

Isomeric SMILES

CC(C)(CCN1C=C(C=N1)NC(=O)NC(CCSC)C(=O)OC)OC

InChI

InChI=1S/C16H28N4O4S/c1-16(2,24-4)7-8-20-11-12(10-17-20)18-15(22)19-13(6-9-25-5)14(21)23-3/h10-11,13H,6-9H2,1-5H3,(H2,18,19,22)