N-[2-(tert-butylamino)-2-oxidanylidene-1-phenyl-ethyl]-3-iodanyl-N-(4-methoxyphenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-1-phenyl-ethyl]-3-iodanyl-N-(4-methoxyphenyl)-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-1-phenyl-ethyl]-3-iodo-N-(4-methoxyphenyl)benzothiophene-2-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxo-1-phenylethyl]-3-iodo-N-(4-methoxyphenyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxo-1-phenylethyl]-3-iodo-N-(4-methoxyphenyl)-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-1-phenyl-ethyl]-3-iodo-N-(4-methoxyphenyl)benzothiophene-2-carboxamide Formula: C28H27IN2O3S MolecularWeight: 598.49505

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC=CC=C1)N(C2=CC=C(C=C2)OC)C(=O)C3=C(C4=CC=CC=C4S3)I

Isomeric SMILES

CC(C)(C)NC(=O)C(C1=CC=CC=C1)N(C2=CC=C(C=C2)OC)C(=O)C3=C(C4=CC=CC=C4S3)I

InChI

InChI=1S/C28H27IN2O3S/c1-28(2,3)30-26(32)24(18-10-6-5-7-11-18)31(19-14-16-20(34-4)17-15-19)27(33)25-23(29)21-12-8-9-13-22(21)35-25/h5-17,24H,1-4H3,(H,30,32)