(2S)-5-chloranyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: (2S)-5-chloranyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: (2S)-5-chloro-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: (2S)-5-chloro-N-[[4-(1-pyrazolylmethyl)phenyl]methyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: (2S)-5-chloro-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: (2S)-5-chloro-N-[4-(pyrazol-1-ylmethyl)benzyl]coumaran-2-carboxamide Formula: C20H18ClN3O2 MolecularWeight: 367.82882

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)Cl)C(=O)NCC3=CC=C(C=C3)CN4C=CC=N4

Isomeric SMILES

C1[C@H](OC2=C1C=C(C=C2)Cl)C(=O)NCC3=CC=C(C=C3)CN4C=CC=N4

InChI

InChI=1S/C20H18ClN3O2/c21-17-6-7-18-16(10-17)11-19(26-18)20(25)22-12-14-2-4-15(5-3-14)13-24-9-1-8-23-24/h1-10,19H,11-13H2,(H,22,25)/t19-/m0/s1