2-chloranyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[[4-(1-pyrazolylmethyl)phenyl]methyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[4-(pyrazol-1-ylmethyl)benzyl]-5-pyrrolidinosulfonyl-benzamide Formula: C22H23ClN4O3S MolecularWeight: 458.96102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3=CC=C(C=C3)CN4C=CC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3=CC=C(C=C3)CN4C=CC=N4

InChI

InChI=1S/C22H23ClN4O3S/c23-21-9-8-19(31(29,30)27-12-1-2-13-27)14-20(21)22(28)24-15-17-4-6-18(7-5-17)16-26-11-3-10-25-26/h3-11,14H,1-2,12-13,15-16H2,(H,24,28)