4-cyano-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylic acid

Systemtic Name: 4-cyano-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylic acid Openeye Name: 3-(tert-butoxycarbonylamino)-4-cyano-5-methyl-thiophene-2-carboxylic acid CAS Name: 4-cyano-5-methyl-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 4-cyano-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylic acid Traditional Name: 3-(tert-butoxycarbonylamino)-4-cyano-5-methyl-2-thenoic acid Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)C(=O)O)NC(=O)OC(C)(C)C)C#N

Isomeric SMILES

CC1=C(C(=C(S1)C(=O)O)NC(=O)OC(C)(C)C)C#N

InChI

InChI=1S/C12H14N2O4S/c1-6-7(5-13)8(9(19-6)10(15)16)14-11(17)18-12(2,3)4/h1-4H3,(H,14,17)(H,15,16)