1-[(4-butoxy-3-ethoxy-phenyl)carbonylamino]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[(4-butoxy-3-ethoxy-phenyl)carbonylamino]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[(4-butoxy-3-ethoxy-benzoyl)amino]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[[(4-butoxy-3-ethoxyphenyl)-oxomethyl]amino]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[(4-butoxy-3-ethoxybenzoyl)amino]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[(4-butoxy-3-ethoxy-benzoyl)amino]-3-(4-fluorobenzyl)thiourea Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NNC(=S)NCC2=CC=C(C=C2)F)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NNC(=S)NCC2=CC=C(C=C2)F)OCC

InChI

InChI=1S/C21H26FN3O3S/c1-3-5-12-28-18-11-8-16(13-19(18)27-4-2)20(26)24-25-21(29)23-14-15-6-9-17(22)10-7-15/h6-11,13H,3-5,12,14H2,1-2H3,(H,24,26)(H2,23,25,29)