N-[2-[6-(2,5-dimethylpyrrol-1-yl)pyridin-3-yl]-2-oxidanyl-ethyl]-6-iodanyl-3,4-dihydro-2H-chromene-2-carboxamide

Systemtic Name: N-[2-[6-(2,5-dimethylpyrrol-1-yl)pyridin-3-yl]-2-oxidanyl-ethyl]-6-iodanyl-3,4-dihydro-2H-chromene-2-carboxamide Openeye Name: N-[2-[6-(2,5-dimethylpyrrol-1-yl)-3-pyridyl]-2-hydroxy-ethyl]-6-iodo-chromane-2-carboxamide CAS Name: N-[2-[6-(2,5-dimethyl-1-pyrrolyl)-3-pyridinyl]-2-hydroxyethyl]-6-iodo-3,4-dihydro-2H-1-benzopyran-2-carboxamide IUPAC Name: N-[2-[6-(2,5-dimethylpyrrol-1-yl)pyridin-3-yl]-2-hydroxyethyl]-6-iodo-3,4-dihydro-2H-chromene-2-carboxamide Traditional Name: N-[2-[6-(2,5-dimethylpyrrol-1-yl)-3-pyridyl]-2-hydroxy-ethyl]-6-iodo-chroman-2-carboxamide Formula: C23H24IN3O3 MolecularWeight: 517.35943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=NC=C(C=C2)C(CNC(=O)C3CCC4=C(O3)C=CC(=C4)I)O)C

Isomeric SMILES

CC1=CC=C(N1C2=NC=C(C=C2)C(CNC(=O)C3CCC4=C(O3)C=CC(=C4)I)O)C

InChI

InChI=1S/C23H24IN3O3/c1-14-3-4-15(2)27(14)22-10-6-17(12-25-22)19(28)13-26-23(29)21-8-5-16-11-18(24)7-9-20(16)30-21/h3-4,6-7,9-12,19,21,28H,5,8,13H2,1-2H3,(H,26,29)