ethyl 5-iodanyl-2-(2-naphthalen-2-yloxyethanoylamino)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-iodanyl-2-(2-naphthalen-2-yloxyethanoylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 5-iodo-2-[[2-(2-naphthyloxy)acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 5-iodo-2-[[2-(2-naphthalenyloxy)-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-iodo-2-[(2-naphthalen-2-yloxyacetyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 5-iodo-2-[[2-(2-naphthoxy)acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H20INO4S MolecularWeight: 557.40007

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)I)NC(=O)COC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)I)NC(=O)COC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H20INO4S/c1-2-30-25(29)22-21(17-9-4-3-5-10-17)23(26)32-24(22)27-20(28)15-31-19-13-12-16-8-6-7-11-18(16)14-19/h3-14H,2,15H2,1H3,(H,27,28)