methyl 2-[(4-iodanyl-1H-pyrazol-5-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(4-iodanyl-1H-pyrazol-5-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(4-iodo-1H-pyrazole-5-carbonyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(4-iodo-1H-pyrazol-5-yl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-iodo-1H-pyrazole-5-carbonyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(4-iodo-1H-pyrazole-5-carbonyl)amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C11H10IN3O3S MolecularWeight: 391.18487

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=C(C=NN2)I)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=C(C=NN2)I)C(=O)OC

InChI

InChI=1S/C11H10IN3O3S/c1-5-3-6(11(17)18-2)10(19-5)14-9(16)8-7(12)4-13-15-8/h3-4H,1-2H3,(H,13,15)(H,14,16)