methyl 2-[[5-bromanyl-2-(3-methylbutoxy)phenyl]carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[[5-bromanyl-2-(3-methylbutoxy)phenyl]carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[(5-bromo-2-isopentyloxy-benzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[[5-bromo-2-(3-methylbutoxy)phenyl]-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[5-bromo-2-(3-methylbutoxy)benzoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[(5-bromo-2-isoamoxy-benzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C21H24BrNO4S MolecularWeight: 466.38856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)Br)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)Br)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC

InChI

InChI=1S/C21H24BrNO4S/c1-12(2)9-10-27-16-8-7-13(22)11-15(16)19(24)23-20-18(21(25)26-3)14-5-4-6-17(14)28-20/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,23,24)