methyl 2-[(3-iodanylphenyl)carbonylamino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(3-iodanylphenyl)carbonylamino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: methyl 2-[(3-iodobenzoyl)amino]-5-isopropyl-thiophene-3-carboxylate CAS Name: 2-[[(3-iodophenyl)-oxomethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-iodobenzoyl)amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 2-[(3-iodobenzoyl)amino]-5-isopropyl-thiophene-3-carboxylic acid methyl ester Formula: C16H16INO3S MolecularWeight: 429.27261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(S1)NC(=O)C2=CC(=CC=C2)I)C(=O)OC

Isomeric SMILES

CC(C)C1=CC(=C(S1)NC(=O)C2=CC(=CC=C2)I)C(=O)OC

InChI

InChI=1S/C16H16INO3S/c1-9(2)13-8-12(16(20)21-3)15(22-13)18-14(19)10-5-4-6-11(17)7-10/h4-9H,1-3H3,(H,18,19)