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

Systemtic Name: 1-(2-bromanyl-4-fluoranyl-phenyl)-3-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiourea Openeye Name: 1-(2-bromo-4-fluoro-phenyl)-3-[3-(1-methyl-4-piperidyl)-1H-indol-5-yl]thiourea CAS Name: 1-(2-bromo-4-fluorophenyl)-3-[3-(1-methyl-4-piperidinyl)-1H-indol-5-yl]thiourea IUPAC Name: 1-(2-bromo-4-fluorophenyl)-3-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiourea Traditional Name: 1-(2-bromo-4-fluoro-phenyl)-3-[3-(1-methyl-4-piperidyl)-1H-indol-5-yl]thiourea Formula: C21H22BrFN4S MolecularWeight: 461.393583

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2=CNC3=C2C=C(C=C3)NC(=S)NC4=C(C=C(C=C4)F)Br

Isomeric SMILES

CN1CCC(CC1)C2=CNC3=C2C=C(C=C3)NC(=S)NC4=C(C=C(C=C4)F)Br

InChI

InChI=1S/C21H22BrFN4S/c1-27-8-6-13(7-9-27)17-12-24-19-5-3-15(11-16(17)19)25-21(28)26-20-4-2-14(23)10-18(20)22/h2-5,10-13,24H,6-9H2,1H3,(H2,25,26,28)