ethyl 6-methyl-2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 6-methyl-2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 6-methyl-2-[[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-methyl-2-[[1-oxo-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-2-[[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-methyl-2-[[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C28H39NO4S MolecularWeight: 485.67856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)COC3=CC=C(C=C3)C(C)(C)CC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)COC3=CC=C(C=C3)C(C)(C)CC(C)(C)C

InChI

InChI=1S/C28H39NO4S/c1-8-32-26(31)24-21-14-9-18(2)15-22(21)34-25(24)29-23(30)16-33-20-12-10-19(11-13-20)28(6,7)17-27(3,4)5/h10-13,18H,8-9,14-17H2,1-7H3,(H,29,30)