O4-ethyl O2-propan-2-yl 5-[4-(2-bromanyl-4-tert-butyl-phenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-propan-2-yl 5-[4-(2-bromanyl-4-tert-butyl-phenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-isopropyl 5-[4-(2-bromo-4-tert-butyl-phenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[4-(2-bromo-4-tert-butylphenoxy)-1-oxobutyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O4-ethyl ester O2-propan-2-yl ester IUPAC Name: 4-O-ethyl 2-O-propan-2-yl 5-[4-(2-bromo-4-tert-butylphenoxy)butanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[4-(2-bromo-4-tert-butyl-phenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-isopropyl ester Formula: C26H34BrNO6S MolecularWeight: 568.52026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)CCCOC2=C(C=C(C=C2)C(C)(C)C)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)CCCOC2=C(C=C(C=C2)C(C)(C)C)Br

InChI

InChI=1S/C26H34BrNO6S/c1-8-32-24(30)21-16(4)22(25(31)34-15(2)3)35-23(21)28-20(29)10-9-13-33-19-12-11-17(14-18(19)27)26(5,6)7/h11-12,14-15H,8-10,13H2,1-7H3,(H,28,29)