methyl 5-(2-iodanylethanoylamino)-4-(phenylcarbonyl)thiophene-2-carboxylate

Systemtic Name: methyl 5-(2-iodanylethanoylamino)-4-(phenylcarbonyl)thiophene-2-carboxylate Openeye Name: methyl 4-benzoyl-5-[(2-iodoacetyl)amino]thiophene-2-carboxylate CAS Name: 4-benzoyl-5-[(2-iodo-1-oxoethyl)amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-benzoyl-5-[(2-iodoacetyl)amino]thiophene-2-carboxylate Traditional Name: 4-benzoyl-5-[(2-iodoacetyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C15H12INO4S MolecularWeight: 429.22955

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)NC(=O)CI)C(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC(=C(S1)NC(=O)CI)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H12INO4S/c1-21-15(20)11-7-10(14(22-11)17-12(18)8-16)13(19)9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H,17,18)