tert-butyl 4-cyano-5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: tert-butyl 4-cyano-5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: tert-butyl 4-cyano-5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[(2,2-dimethyl-1-oxopropyl)amino]-3-methyl-2-thiophenecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-cyano-5-(2,2-dimethylpropanoylamino)-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-(pivaloylamino)thiophene-2-carboxylic acid tert-butyl ester Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H22N2O3S/c1-9-10(8-17)12(18-14(20)15(2,3)4)22-11(9)13(19)21-16(5,6)7/h1-7H3,(H,18,20)