1-(4-butylphenyl)-3-[2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[2-(4-fluorophenyl)-2-morpholino-ethyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[2-(4-fluorophenyl)-2-(4-morpholinyl)ethyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[2-(4-fluorophenyl)-2-morpholino-ethyl]thiourea Formula: C23H30FN3OS MolecularWeight: 415.567203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC(C2=CC=C(C=C2)F)N3CCOCC3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC(C2=CC=C(C=C2)F)N3CCOCC3

InChI

InChI=1S/C23H30FN3OS/c1-2-3-4-18-5-11-21(12-6-18)26-23(29)25-17-22(27-13-15-28-16-14-27)19-7-9-20(24)10-8-19/h5-12,22H,2-4,13-17H2,1H3,(H2,25,26,29)