2-[(3-iodanyl-4-methoxy-phenyl)carbonylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide

Systemtic Name: 2-[(3-iodanyl-4-methoxy-phenyl)carbonylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide Openeye Name: 5-benzyl-2-[(3-iodo-4-methoxy-benzoyl)amino]-4-methyl-thiophene-3-carboxamide CAS Name: 2-[[(3-iodo-4-methoxyphenyl)-oxomethyl]amino]-4-methyl-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-2-[(3-iodo-4-methoxybenzoyl)amino]-4-methylthiophene-3-carboxamide Traditional Name: 5-benzyl-2-[(3-iodo-4-methoxy-benzoyl)amino]-4-methyl-thiophene-3-carboxamide Formula: C21H19IN2O3S MolecularWeight: 506.35663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC(=C(C=C2)OC)I)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC(=C(C=C2)OC)I)CC3=CC=CC=C3

InChI

InChI=1S/C21H19IN2O3S/c1-12-17(10-13-6-4-3-5-7-13)28-21(18(12)19(23)25)24-20(26)14-8-9-16(27-2)15(22)11-14/h3-9,11H,10H2,1-2H3,(H2,23,25)(H,24,26)