(2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(3-iodanylphenyl)propanamide

Systemtic Name: (2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(3-iodanylphenyl)propanamide Openeye Name: (2S)-2-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]-N-(3-iodophenyl)propanamide CAS Name: (2S)-2-[(3,5-dimethyl-4-isoxazolyl)sulfonylamino]-N-(3-iodophenyl)propanamide IUPAC Name: (2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(3-iodophenyl)propanamide Traditional Name: (2S)-2-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]-N-(3-iodophenyl)propionamide Formula: C14H16IN3O4S MolecularWeight: 449.26401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NC(C)C(=O)NC2=CC(=CC=C2)I

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N[C@@H](C)C(=O)NC2=CC(=CC=C2)I

InChI

InChI=1S/C14H16IN3O4S/c1-8-13(10(3)22-17-8)23(20,21)18-9(2)14(19)16-12-6-4-5-11(15)7-12/h4-7,9,18H,1-3H3,(H,16,19)/t9-/m0/s1