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

Systemtic Name: 1-[3-(1-butylpiperidin-4-yl)-2H-indazol-5-yl]-3-(3-chloranyl-5-fluoranyl-phenyl)thiourea Openeye Name: 1-[3-(1-butyl-4-piperidyl)-2H-indazol-5-yl]-3-(3-chloro-5-fluoro-phenyl)thiourea CAS Name: 1-[3-(1-butyl-4-piperidinyl)-2H-indazol-5-yl]-3-(3-chloro-5-fluorophenyl)thiourea IUPAC Name: 1-[3-(1-butylpiperidin-4-yl)-2H-indazol-5-yl]-3-(3-chloro-5-fluorophenyl)thiourea Traditional Name: 1-[3-(1-butyl-4-piperidyl)-2H-indazol-5-yl]-3-(3-chloro-5-fluoro-phenyl)thiourea Formula: C23H27ClFN5S MolecularWeight: 460.010383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)C2=C3C=C(C=CC3=NN2)NC(=S)NC4=CC(=CC(=C4)Cl)F

Isomeric SMILES

CCCCN1CCC(CC1)C2=C3C=C(C=CC3=NN2)NC(=S)NC4=CC(=CC(=C4)Cl)F

InChI

InChI=1S/C23H27ClFN5S/c1-2-3-8-30-9-6-15(7-10-30)22-20-14-18(4-5-21(20)28-29-22)26-23(31)27-19-12-16(24)11-17(25)13-19/h4-5,11-15H,2-3,6-10H2,1H3,(H,28,29)(H2,26,27,31)