3-[5-chloranyl-6-(3-fluorophenyl)pyridin-3-yl]-1-methyl-1-(1-propylsulfonylpiperidin-4-yl)urea

Systemtic Name: 3-[5-chloranyl-6-(3-fluorophenyl)pyridin-3-yl]-1-methyl-1-(1-propylsulfonylpiperidin-4-yl)urea Openeye Name: 3-[5-chloro-6-(3-fluorophenyl)-3-pyridyl]-1-methyl-1-(1-propylsulfonyl-4-piperidyl)urea CAS Name: 3-[5-chloro-6-(3-fluorophenyl)-3-pyridinyl]-1-methyl-1-(1-propylsulfonyl-4-piperidinyl)urea IUPAC Name: 3-[5-chloro-6-(3-fluorophenyl)pyridin-3-yl]-1-methyl-1-(1-propylsulfonylpiperidin-4-yl)urea Traditional Name: 3-[5-chloro-6-(3-fluorophenyl)-3-pyridyl]-1-methyl-1-(1-propylsulfonyl-4-piperidyl)urea Formula: C21H26ClFN4O3S MolecularWeight: 468.972543

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC(CC1)N(C)C(=O)NC2=CC(=C(N=C2)C3=CC(=CC=C3)F)Cl

Isomeric SMILES

CCCS(=O)(=O)N1CCC(CC1)N(C)C(=O)NC2=CC(=C(N=C2)C3=CC(=CC=C3)F)Cl

InChI

InChI=1S/C21H26ClFN4O3S/c1-3-11-31(29,30)27-9-7-18(8-10-27)26(2)21(28)25-17-13-19(22)20(24-14-17)15-5-4-6-16(23)12-15/h4-6,12-14,18H,3,7-11H2,1-2H3,(H,25,28)