1-[[1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-pyridazin-3-yl]carbonylamino]-3-pentyl-thiourea

Systemtic Name: 1-[[1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-pyridazin-3-yl]carbonylamino]-3-pentyl-thiourea Openeye Name: 1-[[1-(2-fluorophenyl)-6-methyl-4-oxo-pyridazine-3-carbonyl]amino]-3-pentyl-thiourea CAS Name: 1-[[[1-(2-fluorophenyl)-6-methyl-4-oxo-3-pyridazinyl]-oxomethyl]amino]-3-pentylthiourea IUPAC Name: 1-[[1-(2-fluorophenyl)-6-methyl-4-oxopyridazine-3-carbonyl]amino]-3-pentylthiourea Traditional Name: 1-amyl-3-[[1-(2-fluorophenyl)-4-keto-6-methyl-pyridazine-3-carbonyl]amino]thiourea Formula: C18H22FN5O2S MolecularWeight: 391.462983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C1=NN(C(=CC1=O)C)C2=CC=CC=C2F

Isomeric SMILES

CCCCCNC(=S)NNC(=O)C1=NN(C(=CC1=O)C)C2=CC=CC=C2F

InChI

InChI=1S/C18H22FN5O2S/c1-3-4-7-10-20-18(27)22-21-17(26)16-15(25)11-12(2)24(23-16)14-9-6-5-8-13(14)19/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,21,26)(H2,20,22,27)