methyl 5-[(2-chloranyl-5-iodanyl-phenyl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-[(2-chloranyl-5-iodanyl-phenyl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-[(2-chloro-5-iodo-benzoyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(2-chloro-5-iodophenyl)-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(2-chloro-5-iodobenzoyl)amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[(2-chloro-5-iodo-benzoyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C15H10ClIN2O3S MolecularWeight: 460.67397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=C(C=CC(=C2)I)Cl)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=C(C=CC(=C2)I)Cl)C(=O)OC

InChI

InChI=1S/C15H10ClIN2O3S/c1-7-10(6-18)14(23-12(7)15(21)22-2)19-13(20)9-5-8(17)3-4-11(9)16/h3-5H,1-2H3,(H,19,20)