4-cyano-N-(3,3-dimethylbutan-2-yl)-5-(2-ethylbutanoylamino)-N-[(4-fluorophenyl)methyl]-3-methyl-thiophene-2-carboxamide

Systemtic Name: 4-cyano-N-(3,3-dimethylbutan-2-yl)-5-(2-ethylbutanoylamino)-N-[(4-fluorophenyl)methyl]-3-methyl-thiophene-2-carboxamide Openeye Name: 4-cyano-5-(2-ethylbutanoylamino)-N-[(4-fluorophenyl)methyl]-3-methyl-N-(1,2,2-trimethylpropyl)thiophene-2-carboxamide CAS Name: 4-cyano-N-(3,3-dimethylbutan-2-yl)-5-[(2-ethyl-1-oxobutyl)amino]-N-[(4-fluorophenyl)methyl]-3-methyl-2-thiophenecarboxamide IUPAC Name: 4-cyano-N-(3,3-dimethylbutan-2-yl)-5-(2-ethylbutanoylamino)-N-[(4-fluorophenyl)methyl]-3-methylthiophene-2-carboxamide Traditional Name: 4-cyano-5-(2-ethylbutanoylamino)-N-(4-fluorobenzyl)-3-methyl-N-(1,2,2-trimethylpropyl)thiophene-2-carboxamide Formula: C26H34FN3O2S MolecularWeight: 471.630463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=C(C(=C(S1)C(=O)N(CC2=CC=C(C=C2)F)C(C)C(C)(C)C)C)C#N

Isomeric SMILES

CCC(CC)C(=O)NC1=C(C(=C(S1)C(=O)N(CC2=CC=C(C=C2)F)C(C)C(C)(C)C)C)C#N

InChI

InChI=1S/C26H34FN3O2S/c1-8-19(9-2)23(31)29-24-21(14-28)16(3)22(33-24)25(32)30(17(4)26(5,6)7)15-18-10-12-20(27)13-11-18/h10-13,17,19H,8-9,15H2,1-7H3,(H,29,31)