2-[4-(2-bromanyl-4-tert-butyl-phenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Systemtic Name: 2-[4-(2-bromanyl-4-tert-butyl-phenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Openeye Name: 2-[4-(2-bromo-4-tert-butyl-phenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide CAS Name: 2-[[4-(2-bromo-4-tert-butylphenoxy)-1-oxobutyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide IUPAC Name: 2-[4-(2-bromo-4-tert-butylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Traditional Name: 2-[4-(2-bromo-4-tert-butyl-phenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Formula: C22H27BrN2O3S MolecularWeight: 479.43038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)N)Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)N)Br

InChI

InChI=1S/C22H27BrN2O3S/c1-22(2,3)13-9-10-16(15(23)12-13)28-11-5-8-18(26)25-21-19(20(24)27)14-6-4-7-17(14)29-21/h9-10,12H,4-8,11H2,1-3H3,(H2,24,27)(H,25,26)