1-[(3-methoxy-4-oxidanyl-phenyl)methylsulfanylcarbamoylamino]propyl 2,2-dimethylpropanoate

Systemtic Name: 1-[(3-methoxy-4-oxidanyl-phenyl)methylsulfanylcarbamoylamino]propyl 2,2-dimethylpropanoate Openeye Name: 1-[(4-hydroxy-3-methoxy-phenyl)methylsulfanylcarbamoylamino]propyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 1-[[[[(4-hydroxy-3-methoxyphenyl)methylthio]amino]-oxomethyl]amino]propyl ester IUPAC Name: 1-[(4-hydroxy-3-methoxyphenyl)methylsulfanylcarbamoylamino]propyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 1-[(vanillylthio)carbamoylamino]propyl ester Formula: C17H26N2O5S MolecularWeight: 370.46374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC(=O)NSCC1=CC(=C(C=C1)O)OC)OC(=O)C(C)(C)C

Isomeric SMILES

CCC(NC(=O)NSCC1=CC(=C(C=C1)O)OC)OC(=O)C(C)(C)C

InChI

InChI=1S/C17H26N2O5S/c1-6-14(24-15(21)17(2,3)4)18-16(22)19-25-10-11-7-8-12(20)13(9-11)23-5/h7-9,14,20H,6,10H2,1-5H3,(H2,18,19,22)