1-[3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-5-fluoranyl-phenyl]-3-(1,2-oxazol-3-yl)urea

Systemtic Name: 1-[3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-5-fluoranyl-phenyl]-3-(1,2-oxazol-3-yl)urea Openeye Name: 1-[3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-5-fluoro-phenyl]-3-isoxazol-3-yl-urea CAS Name: 1-[3-[(4-ethylsulfonyl-1-piperazinyl)methyl]-5-fluorophenyl]-3-(3-isoxazolyl)urea IUPAC Name: 1-[3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-5-fluorophenyl]-3-(1,2-oxazol-3-yl)urea Traditional Name: 1-[3-[(4-esylpiperazino)methyl]-5-fluoro-phenyl]-3-isoxazol-3-yl-urea Formula: C17H22FN5O4S MolecularWeight: 411.451083

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)CC2=CC(=CC(=C2)F)NC(=O)NC3=NOC=C3

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)CC2=CC(=CC(=C2)F)NC(=O)NC3=NOC=C3

InChI

InChI=1S/C17H22FN5O4S/c1-2-28(25,26)23-6-4-22(5-7-23)12-13-9-14(18)11-15(10-13)19-17(24)20-16-3-8-27-21-16/h3,8-11H,2,4-7,12H2,1H3,(H2,19,20,21,24)