N-phenethyl-2-[2-(2,4,6-trimethylphenoxy)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-phenethyl-2-[2-(2,4,6-trimethylphenoxy)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-phenethyl-2-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[1-oxo-2-(2,4,6-trimethylphenoxy)ethyl]amino]-N-phenethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-phenethyl-2-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-phenethyl-2-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C28H32N2O3S MolecularWeight: 476.63028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C28H32N2O3S/c1-18-15-19(2)26(20(3)16-18)33-17-24(31)30-28-25(22-11-7-8-12-23(22)34-28)27(32)29-14-13-21-9-5-4-6-10-21/h4-6,9-10,15-16H,7-8,11-14,17H2,1-3H3,(H,29,32)(H,30,31)