(3S)-N-[(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]-N-(2-iodanyl-4-methoxy-phenyl)-3-phenyl-butanamide

Systemtic Name: (3S)-N-[(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]-N-(2-iodanyl-4-methoxy-phenyl)-3-phenyl-butanamide Openeye Name: (3S)-N-[(1S)-2-(tert-butylamino)-1-methyl-2-oxo-ethyl]-N-(2-iodo-4-methoxy-phenyl)-3-phenyl-butanamide CAS Name: (3S)-N-[(2S)-1-(tert-butylamino)-1-oxopropan-2-yl]-N-(2-iodo-4-methoxyphenyl)-3-phenylbutanamide IUPAC Name: (3S)-N-[(2S)-1-(tert-butylamino)-1-oxopropan-2-yl]-N-(2-iodo-4-methoxyphenyl)-3-phenylbutanamide Traditional Name: (3S)-N-[(1S)-2-(tert-butylamino)-2-keto-1-methyl-ethyl]-N-(2-iodo-4-methoxy-phenyl)-3-phenyl-butyramide Formula: C24H31IN2O3 MolecularWeight: 522.41901

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](CC(=O)N(C1=C(C=C(C=C1)OC)I)[C@@H](C)C(=O)NC(C)(C)C)C2=CC=CC=C2

InChI

InChI=1S/C24H31IN2O3/c1-16(18-10-8-7-9-11-18)14-22(28)27(17(2)23(29)26-24(3,4)5)21-13-12-19(30-6)15-20(21)25/h7-13,15-17H,14H2,1-6H3,(H,26,29)/t16-,17-/m0/s1