1-(2-ethyl-6-methyl-phenyl)-3-[[4-(4-fluorophenyl)-4-oxidanylidene-butanoyl]amino]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[4-(4-fluorophenyl)-4-oxidanylidene-butanoyl]amino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[4-(4-fluorophenyl)-4-oxo-butanoyl]amino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[[4-(4-fluorophenyl)-1,4-dioxobutyl]amino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[[4-(4-fluorophenyl)-4-oxobutanoyl]amino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[4-(4-fluorophenyl)-4-keto-butanoyl]amino]thiourea Formula: C20H22FN3O2S MolecularWeight: 387.470983

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)CCC(=O)C2=CC=C(C=C2)F)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)CCC(=O)C2=CC=C(C=C2)F)C

InChI

InChI=1S/C20H22FN3O2S/c1-3-14-6-4-5-13(2)19(14)22-20(27)24-23-18(26)12-11-17(25)15-7-9-16(21)10-8-15/h4-10H,3,11-12H2,1-2H3,(H,23,26)(H2,22,24,27)