1-[[3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazol-4-yl]carbonylamino]-3-pentyl-thiourea

Systemtic Name: 1-[[3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazol-4-yl]carbonylamino]-3-pentyl-thiourea Openeye Name: 1-[[3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carbonyl]amino]-3-pentyl-thiourea CAS Name: 1-[[[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]-oxomethyl]amino]-3-pentylthiourea IUPAC Name: 1-[[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3-pentylthiourea Traditional Name: 1-amyl-3-[[3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carbonyl]amino]thiourea Formula: C17H20ClFN4O2S MolecularWeight: 398.882703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C1=C(ON=C1C2=C(C=CC=C2Cl)F)C

Isomeric SMILES

CCCCCNC(=S)NNC(=O)C1=C(ON=C1C2=C(C=CC=C2Cl)F)C

InChI

InChI=1S/C17H20ClFN4O2S/c1-3-4-5-9-20-17(26)22-21-16(24)13-10(2)25-23-15(13)14-11(18)7-6-8-12(14)19/h6-8H,3-5,9H2,1-2H3,(H,21,24)(H2,20,22,26)