N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-fluoranyl-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-fluoranyl-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-fluoro-3-morpholinosulfonyl-benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-fluoro-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-fluoro-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-fluoro-3-morpholinosulfonyl-benzamide Formula: C24H20FN3O4S2 MolecularWeight: 497.561703

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC(=C3)C4=NC5=CC=CC=C5S4)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC(=C3)C4=NC5=CC=CC=C5S4)F

InChI

InChI=1S/C24H20FN3O4S2/c25-19-9-8-16(15-22(19)34(30,31)28-10-12-32-13-11-28)23(29)26-18-5-3-4-17(14-18)24-27-20-6-1-2-7-21(20)33-24/h1-9,14-15H,10-13H2,(H,26,29)