1-[2-fluoranyl-3-[(4-morpholin-4-ylsulfonylpiperazin-1-yl)methyl]phenyl]-3-(6-methylpyridin-3-yl)urea

Systemtic Name: 1-[2-fluoranyl-3-[(4-morpholin-4-ylsulfonylpiperazin-1-yl)methyl]phenyl]-3-(6-methylpyridin-3-yl)urea Openeye Name: 1-[2-fluoro-3-[(4-morpholinosulfonylpiperazin-1-yl)methyl]phenyl]-3-(6-methyl-3-pyridyl)urea CAS Name: 1-[2-fluoro-3-[[4-(4-morpholinylsulfonyl)-1-piperazinyl]methyl]phenyl]-3-(6-methyl-3-pyridinyl)urea IUPAC Name: 1-[2-fluoro-3-[(4-morpholin-4-ylsulfonylpiperazin-1-yl)methyl]phenyl]-3-(6-methylpyridin-3-yl)urea Traditional Name: 1-[2-fluoro-3-[(4-morpholinosulfonylpiperazino)methyl]phenyl]-3-(6-methyl-3-pyridyl)urea Formula: C22H29FN6O4S MolecularWeight: 492.566863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)NC(=O)NC2=CC=CC(=C2F)CN3CCN(CC3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=NC=C(C=C1)NC(=O)NC2=CC=CC(=C2F)CN3CCN(CC3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H29FN6O4S/c1-17-5-6-19(15-24-17)25-22(30)26-20-4-2-3-18(21(20)23)16-27-7-9-28(10-8-27)34(31,32)29-11-13-33-14-12-29/h2-6,15H,7-14,16H2,1H3,(H2,25,26,30)