4-fluoranyl-3-morpholin-4-ylsulfonyl-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]benzamide

Systemtic Name: 4-fluoranyl-3-morpholin-4-ylsulfonyl-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]benzamide Openeye Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-4-fluoro-3-morpholinosulfonyl-benzamide CAS Name: 4-fluoro-3-(4-morpholinylsulfonyl)-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]benzamide IUPAC Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-4-fluoro-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-4-fluoro-3-morpholinosulfonyl-benzamide Formula: C25H27FN4O4S MolecularWeight: 498.569683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)N(N=C2)CC3=CC=CC=C3)NC(=O)C4=CC(=C(C=C4)F)S(=O)(=O)N5CCOCC5

Isomeric SMILES

C1CC(C2=C(C1)N(N=C2)CC3=CC=CC=C3)NC(=O)C4=CC(=C(C=C4)F)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C25H27FN4O4S/c26-21-10-9-19(15-24(21)35(32,33)29-11-13-34-14-12-29)25(31)28-22-7-4-8-23-20(22)16-27-30(23)17-18-5-2-1-3-6-18/h1-3,5-6,9-10,15-16,22H,4,7-8,11-14,17H2,(H,28,31)