2-chloranyl-6-fluoranyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 2-chloranyl-6-fluoranyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 2-chloro-6-fluoro-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 2-chloro-6-fluoro-N-[6-(1-pyrrolidinylsulfonyl)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 2-chloro-6-fluoro-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 2-chloro-6-fluoro-N-(6-pyrrolidinosulfonyl-1,3-benzothiazol-2-yl)benzamide Formula: C18H15ClFN3O3S2 MolecularWeight: 439.911403

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4=C(C=CC=C4Cl)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C18H15ClFN3O3S2/c19-12-4-3-5-13(20)16(12)17(24)22-18-21-14-7-6-11(10-15(14)27-18)28(25,26)23-8-1-2-9-23/h3-7,10H,1-2,8-9H2,(H,21,22,24)