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4-fluoranyl-3-morpholin-4-ylsulfonyl-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzamide

4-fluoranyl-3-morpholin-4-ylsulfonyl-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzamide

Systemtic Name:4-fluoranyl-3-morpholin-4-ylsulfonyl-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzamide
Openeye Name:4-fluoro-3-morpholinosulfonyl-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzamide
CAS Name:4-fluoro-3-(4-morpholinylsulfonyl)-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzamide
IUPAC Name:4-fluoro-3-morpholin-4-ylsulfonyl-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzamide
Traditional Name:4-fluoro-3-morpholinosulfonyl-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazol[4,3-a]azepin-3-yl)phenyl]benzamide
Formula: C24H26FN5O4S
MolecularWeight: 499.557743
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NN=C(N2CC1)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)F)S(=O)(=O)N5CCOCC5


Isomeric SMILES

C1CCC2=NN=C(N2CC1)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)F)S(=O)(=O)N5CCOCC5


InChI

InChI=1S/C24H26FN5O4S/c25-20-9-8-18(16-21(20)35(32,33)29-11-13-34-14-12-29)24(31)26-19-6-4-5-17(15-19)23-28-27-22-7-2-1-3-10-30(22)23/h4-6,8-9,15-16H,1-3,7,10-14H2,(H,26,31)


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