1-[3-fluoranyl-5-[(4-methyl-3-oxidanylidene-piperazin-1-yl)methyl]phenyl]-3-pyridin-3-yl-urea

Systemtic Name: 1-[3-fluoranyl-5-[(4-methyl-3-oxidanylidene-piperazin-1-yl)methyl]phenyl]-3-pyridin-3-yl-urea Openeye Name: 1-[3-fluoro-5-[(4-methyl-3-oxo-piperazin-1-yl)methyl]phenyl]-3-(3-pyridyl)urea CAS Name: 1-[3-fluoro-5-[(4-methyl-3-oxo-1-piperazinyl)methyl]phenyl]-3-(3-pyridinyl)urea IUPAC Name: 1-[3-fluoro-5-[(4-methyl-3-oxopiperazin-1-yl)methyl]phenyl]-3-pyridin-3-ylurea Traditional Name: 1-[3-fluoro-5-[(3-keto-4-methyl-piperazino)methyl]phenyl]-3-(3-pyridyl)urea Formula: C18H20FN5O2 MolecularWeight: 357.382103

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1=O)CC2=CC(=CC(=C2)F)NC(=O)NC3=CN=CC=C3

Isomeric SMILES

CN1CCN(CC1=O)CC2=CC(=CC(=C2)F)NC(=O)NC3=CN=CC=C3

InChI

InChI=1S/C18H20FN5O2/c1-23-5-6-24(12-17(23)25)11-13-7-14(19)9-16(8-13)22-18(26)21-15-3-2-4-20-10-15/h2-4,7-10H,5-6,11-12H2,1H3,(H2,21,22,26)