1-(3-fluorophenyl)-3-[4-(2-pyridin-3-ylpiperidin-1-yl)sulfonylphenyl]thiourea

Systemtic Name: 1-(3-fluorophenyl)-3-[4-(2-pyridin-3-ylpiperidin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-(3-fluorophenyl)-3-[4-[[2-(3-pyridyl)-1-piperidyl]sulfonyl]phenyl]thiourea CAS Name: 1-(3-fluorophenyl)-3-[4-[[2-(3-pyridinyl)-1-piperidinyl]sulfonyl]phenyl]thiourea IUPAC Name: 1-(3-fluorophenyl)-3-[4-(2-pyridin-3-ylpiperidin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-(3-fluorophenyl)-3-[4-[2-(3-pyridyl)piperidino]sulfonylphenyl]thiourea Formula: C23H23FN4O2S2 MolecularWeight: 470.582723

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=CC(=CC=C4)F

Isomeric SMILES

C1CCN(C(C1)C2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=CC(=CC=C4)F

InChI

InChI=1S/C23H23FN4O2S2/c24-18-6-3-7-20(15-18)27-23(31)26-19-9-11-21(12-10-19)32(29,30)28-14-2-1-8-22(28)17-5-4-13-25-16-17/h3-7,9-13,15-16,22H,1-2,8,14H2,(H2,26,27,31)