N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-7-(2-methoxyethanoylamino)-1-methyl-2-pyridin-3-yl-benzimidazole-5-carboxamide

Systemtic Name: N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-7-(2-methoxyethanoylamino)-1-methyl-2-pyridin-3-yl-benzimidazole-5-carboxamide Openeye Name: N-[[(1S)-isochroman-1-yl]methyl]-7-[(2-methoxyacetyl)amino]-1-methyl-2-(3-pyridyl)benzimidazole-5-carboxamide CAS Name: N-[[(1S)-3,4-dihydro-1H-2-benzopyran-1-yl]methyl]-7-[(2-methoxy-1-oxoethyl)amino]-1-methyl-2-(3-pyridinyl)-5-benzimidazolecarboxamide IUPAC Name: N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-7-[(2-methoxyacetyl)amino]-1-methyl-2-pyridin-3-ylbenzimidazole-5-carboxamide Traditional Name: N-[[(1S)-isochroman-1-yl]methyl]-7-[(2-methoxyacetyl)amino]-1-methyl-2-(3-pyridyl)benzimidazole-5-carboxamide Formula: C27H27N5O4 MolecularWeight: 485.53438

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2NC(=O)COC)C(=O)NCC3C4=CC=CC=C4CCO3)N=C1C5=CN=CC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2NC(=O)COC)C(=O)NC[C@@H]3C4=CC=CC=C4CCO3)N=C1C5=CN=CC=C5

InChI

InChI=1S/C27H27N5O4/c1-32-25-21(30-24(33)16-35-2)12-19(13-22(25)31-26(32)18-7-5-10-28-14-18)27(34)29-15-23-20-8-4-3-6-17(20)9-11-36-23/h3-8,10,12-14,23H,9,11,15-16H2,1-2H3,(H,29,34)(H,30,33)/t23-/m1/s1