2-[[2-(4-bromanylphenoxy)-2-methyl-propanoyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[[2-(4-bromanylphenoxy)-2-methyl-propanoyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-(4-bromophenoxy)-2-methyl-propanoyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-(4-bromophenoxy)-2-methyl-1-oxopropyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-(4-bromophenoxy)-2-methylpropanoyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-(4-bromophenoxy)-2-methyl-propanoyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H23BrN2O3S MolecularWeight: 451.37722

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C(C)(C)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C(C)(C)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H23BrN2O3S/c1-11-4-9-14-15(10-11)27-18(16(14)17(22)24)23-19(25)20(2,3)26-13-7-5-12(21)6-8-13/h5-8,11H,4,9-10H2,1-3H3,(H2,22,24)(H,23,25)