2-[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide

Systemtic Name: 2-[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Openeye Name: 2-[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide CAS Name: 2-[[2-(5-methyl-2-propan-2-ylphenoxy)-1-oxoethyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide IUPAC Name: 2-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Traditional Name: 2-[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)N

InChI

InChI=1S/C22H28N2O3S/c1-13(2)15-10-9-14(3)11-17(15)27-12-19(25)24-22-20(21(23)26)16-7-5-4-6-8-18(16)28-22/h9-11,13H,4-8,12H2,1-3H3,(H2,23,26)(H,24,25)