1-[3-fluoranyl-5-[(4-propylsulfonylpiperazin-1-yl)methyl]phenyl]-3-(6-methylpyridin-3-yl)urea

Systemtic Name: 1-[3-fluoranyl-5-[(4-propylsulfonylpiperazin-1-yl)methyl]phenyl]-3-(6-methylpyridin-3-yl)urea Openeye Name: 1-[3-fluoro-5-[(4-propylsulfonylpiperazin-1-yl)methyl]phenyl]-3-(6-methyl-3-pyridyl)urea CAS Name: 1-[3-fluoro-5-[(4-propylsulfonyl-1-piperazinyl)methyl]phenyl]-3-(6-methyl-3-pyridinyl)urea IUPAC Name: 1-[3-fluoro-5-[(4-propylsulfonylpiperazin-1-yl)methyl]phenyl]-3-(6-methylpyridin-3-yl)urea Traditional Name: 1-[3-fluoro-5-[(4-propylsulfonylpiperazino)methyl]phenyl]-3-(6-methyl-3-pyridyl)urea Formula: C21H28FN5O3S MolecularWeight: 449.542123

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(CC1)CC2=CC(=CC(=C2)F)NC(=O)NC3=CN=C(C=C3)C

Isomeric SMILES

CCCS(=O)(=O)N1CCN(CC1)CC2=CC(=CC(=C2)F)NC(=O)NC3=CN=C(C=C3)C

InChI

InChI=1S/C21H28FN5O3S/c1-3-10-31(29,30)27-8-6-26(7-9-27)15-17-11-18(22)13-20(12-17)25-21(28)24-19-5-4-16(2)23-14-19/h4-5,11-14H,3,6-10,15H2,1-2H3,(H2,24,25,28)