N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[5-[(2-chlorophenyl)methyl]thiazol-2-yl]-4-fluoro-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[5-[(2-chlorophenyl)methyl]-2-thiazolyl]-4-fluoro-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-fluoro-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[5-(2-chlorobenzyl)thiazol-2-yl]-4-fluoro-3-pyrrolidinosulfonyl-benzamide Formula: C21H19ClFN3O3S2 MolecularWeight: 479.975263

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=NC=C(S3)CC4=CC=CC=C4Cl)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=NC=C(S3)CC4=CC=CC=C4Cl)F

InChI

InChI=1S/C21H19ClFN3O3S2/c22-17-6-2-1-5-14(17)11-16-13-24-21(30-16)25-20(27)15-7-8-18(23)19(12-15)31(28,29)26-9-3-4-10-26/h1-2,5-8,12-13H,3-4,9-11H2,(H,24,25,27)