(2S)-5-chloranyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: (2S)-5-chloranyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: (2S)-5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)-2,3-dihydrobenzofuran-2-carboxamide CAS Name: (2S)-5-chloro-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: (2S)-5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: (2S)-5-chloro-N-(4-pyrrolidinosulfonylphenyl)coumaran-2-carboxamide Formula: C19H19ClN2O4S MolecularWeight: 406.88316

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@@H]3CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C19H19ClN2O4S/c20-14-3-8-17-13(11-14)12-18(26-17)19(23)21-15-4-6-16(7-5-15)27(24,25)22-9-1-2-10-22/h3-8,11,18H,1-2,9-10,12H2,(H,21,23)/t18-/m0/s1