2-fluoranyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: 2-fluoranyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: 2-fluoro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5-morpholinosulfonyl-benzamide CAS Name: 2-fluoro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: 2-fluoro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5-morpholin-4-ylsulfonylbenzamide Traditional Name: 2-fluoro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5-morpholinosulfonyl-benzamide Formula: C25H22FN3O4S2 MolecularWeight: 511.588283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)F

InChI

InChI=1S/C25H22FN3O4S2/c1-16-2-9-22-23(14-16)34-25(28-22)17-3-5-18(6-4-17)27-24(30)20-15-19(7-8-21(20)26)35(31,32)29-10-12-33-13-11-29/h2-9,14-15H,10-13H2,1H3,(H,27,30)