1-(4-fluorophenyl)-3-[[4-oxidanylidene-4-(4-pentylphenyl)butanoyl]amino]thiourea

Systemtic Name: 1-(4-fluorophenyl)-3-[[4-oxidanylidene-4-(4-pentylphenyl)butanoyl]amino]thiourea Openeye Name: 1-(4-fluorophenyl)-3-[[4-oxo-4-(4-pentylphenyl)butanoyl]amino]thiourea CAS Name: 1-[[1,4-dioxo-4-(4-pentylphenyl)butyl]amino]-3-(4-fluorophenyl)thiourea IUPAC Name: 1-(4-fluorophenyl)-3-[[4-oxo-4-(4-pentylphenyl)butanoyl]amino]thiourea Traditional Name: 1-[[4-(4-amylphenyl)-4-keto-butanoyl]amino]-3-(4-fluorophenyl)thiourea Formula: C22H26FN3O2S MolecularWeight: 415.524143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)CCC(=O)NNC(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)CCC(=O)NNC(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C22H26FN3O2S/c1-2-3-4-5-16-6-8-17(9-7-16)20(27)14-15-21(28)25-26-22(29)24-19-12-10-18(23)11-13-19/h6-13H,2-5,14-15H2,1H3,(H,25,28)(H2,24,26,29)