1-[[2-(4-fluorophenyl)quinolin-4-yl]carbonylamino]-3-pentyl-thiourea

Systemtic Name: 1-[[2-(4-fluorophenyl)quinolin-4-yl]carbonylamino]-3-pentyl-thiourea Openeye Name: 1-[[2-(4-fluorophenyl)quinoline-4-carbonyl]amino]-3-pentyl-thiourea CAS Name: 1-[[[2-(4-fluorophenyl)-4-quinolinyl]-oxomethyl]amino]-3-pentylthiourea IUPAC Name: 1-[[2-(4-fluorophenyl)quinoline-4-carbonyl]amino]-3-pentylthiourea Traditional Name: 1-amyl-3-[[2-(4-fluorophenyl)quinoline-4-carbonyl]amino]thiourea Formula: C22H23FN4OS MolecularWeight: 410.507623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCCNC(=S)NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H23FN4OS/c1-2-3-6-13-24-22(29)27-26-21(28)18-14-20(15-9-11-16(23)12-10-15)25-19-8-5-4-7-17(18)19/h4-5,7-12,14H,2-3,6,13H2,1H3,(H,26,28)(H2,24,27,29)