1-[3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-1-(2-fluorophenyl)-3-oxidanylidene-propyl]urea

Systemtic Name: 1-[3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-1-(2-fluorophenyl)-3-oxidanylidene-propyl]urea Openeye Name: [3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-1-(2-fluorophenyl)-3-oxo-propyl]urea CAS Name: [3-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-1-(2-fluorophenyl)-3-oxopropyl]urea IUPAC Name: [3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-1-(2-fluorophenyl)-3-oxopropyl]urea Traditional Name: [1-(2-fluorophenyl)-3-keto-3-(4-p-phenetylsulfonylpiperazino)propyl]urea Formula: C22H27FN4O5S MolecularWeight: 478.536983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC(C3=CC=CC=C3F)NC(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC(C3=CC=CC=C3F)NC(=O)N

InChI

InChI=1S/C22H27FN4O5S/c1-2-32-16-7-9-17(10-8-16)33(30,31)27-13-11-26(12-14-27)21(28)15-20(25-22(24)29)18-5-3-4-6-19(18)23/h3-10,20H,2,11-15H2,1H3,(H3,24,25,29)