3-methyl-4-[(2-methylpropan-2-yl)oxycarbonyl]-5-(tetradecylcarbamoylamino)thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-4-[(2-methylpropan-2-yl)oxycarbonyl]-5-(tetradecylcarbamoylamino)thiophene-2-carboxylic acid Openeye Name: 4-tert-butoxycarbonyl-3-methyl-5-(tetradecylcarbamoylamino)thiophene-2-carboxylic acid CAS Name: 3-methyl-4-[(2-methylpropan-2-yl)oxy-oxomethyl]-5-[[oxo-(tetradecylamino)methyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-4-[(2-methylpropan-2-yl)oxycarbonyl]-5-(tetradecylcarbamoylamino)thiophene-2-carboxylic acid Traditional Name: 4-tert-butoxycarbonyl-3-methyl-5-(myristylcarbamoylamino)-2-thenoic acid Formula: C26H44N2O5S MolecularWeight: 496.70296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCNC(=O)NC1=C(C(=C(S1)C(=O)O)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCNC(=O)NC1=C(C(=C(S1)C(=O)O)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H44N2O5S/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-27-25(32)28-22-20(24(31)33-26(3,4)5)19(2)21(34-22)23(29)30/h6-18H2,1-5H3,(H,29,30)(H2,27,28,32)