5-chloranyl-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-2,3-dihydro-1-benzofuran-2-carbohydrazide

Systemtic Name: 5-chloranyl-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-2,3-dihydro-1-benzofuran-2-carbohydrazide Openeye Name: 5-chloro-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)-2,3-dihydrobenzofuran-2-carbohydrazide CAS Name: 5-chloro-N'-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-2,3-dihydrobenzofuran-2-carbohydrazide IUPAC Name: 5-chloro-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)-2,3-dihydro-1-benzofuran-2-carbohydrazide Traditional Name: 5-chloro-N'-(4-pyrrolidinosulfonylbenzoyl)coumaran-2-carbohydrazide Formula: C20H20ClN3O5S MolecularWeight: 449.9079

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClN3O5S/c21-15-5-8-17-14(11-15)12-18(29-17)20(26)23-22-19(25)13-3-6-16(7-4-13)30(27,28)24-9-1-2-10-24/h3-8,11,18H,1-2,9-10,12H2,(H,22,25)(H,23,26)