1-(2-bromanyl-4-fluoranyl-phenyl)-3-[3-(1-hexylpiperidin-4-yl)-2H-indazol-5-yl]thiourea

Systemtic Name: 1-(2-bromanyl-4-fluoranyl-phenyl)-3-[3-(1-hexylpiperidin-4-yl)-2H-indazol-5-yl]thiourea Openeye Name: 1-(2-bromo-4-fluoro-phenyl)-3-[3-(1-hexyl-4-piperidyl)-2H-indazol-5-yl]thiourea CAS Name: 1-(2-bromo-4-fluorophenyl)-3-[3-(1-hexyl-4-piperidinyl)-2H-indazol-5-yl]thiourea IUPAC Name: 1-(2-bromo-4-fluorophenyl)-3-[3-(1-hexylpiperidin-4-yl)-2H-indazol-5-yl]thiourea Traditional Name: 1-(2-bromo-4-fluoro-phenyl)-3-[3-(1-hexyl-4-piperidyl)-2H-indazol-5-yl]thiourea Formula: C25H31BrFN5S MolecularWeight: 532.514543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCC(CC1)C2=C3C=C(C=CC3=NN2)NC(=S)NC4=C(C=C(C=C4)F)Br

Isomeric SMILES

CCCCCCN1CCC(CC1)C2=C3C=C(C=CC3=NN2)NC(=S)NC4=C(C=C(C=C4)F)Br

InChI

InChI=1S/C25H31BrFN5S/c1-2-3-4-5-12-32-13-10-17(11-14-32)24-20-16-19(7-9-22(20)30-31-24)28-25(33)29-23-8-6-18(27)15-21(23)26/h6-9,15-17H,2-5,10-14H2,1H3,(H,30,31)(H2,28,29,33)