1-(3-fluoranyl-4-methyl-phenyl)-3-[[3-methoxy-4-(3-methylbutoxy)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(3-fluoranyl-4-methyl-phenyl)-3-[[3-methoxy-4-(3-methylbutoxy)phenyl]carbonylamino]thiourea Openeye Name: 1-(3-fluoro-4-methyl-phenyl)-3-[(4-isopentyloxy-3-methoxy-benzoyl)amino]thiourea CAS Name: 1-(3-fluoro-4-methylphenyl)-3-[[[3-methoxy-4-(3-methylbutoxy)phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(3-fluoro-4-methylphenyl)-3-[[3-methoxy-4-(3-methylbutoxy)benzoyl]amino]thiourea Traditional Name: 1-(3-fluoro-4-methyl-phenyl)-3-[(4-isoamoxy-3-methoxy-benzoyl)amino]thiourea Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=CC(=C(C=C2)OCCC(C)C)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=CC(=C(C=C2)OCCC(C)C)OC)F

InChI

InChI=1S/C21H26FN3O3S/c1-13(2)9-10-28-18-8-6-15(11-19(18)27-4)20(26)24-25-21(29)23-16-7-5-14(3)17(22)12-16/h5-8,11-13H,9-10H2,1-4H3,(H,24,26)(H2,23,25,29)