3-(2,6-dimethylphenyl)-1-[(3-fluorophenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 3-(2,6-dimethylphenyl)-1-[(3-fluorophenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 3-(2,6-dimethylphenyl)-1-[(3-fluorophenyl)methyl]-1-(3-morpholinopropyl)thiourea CAS Name: 3-(2,6-dimethylphenyl)-1-[(3-fluorophenyl)methyl]-1-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 3-(2,6-dimethylphenyl)-1-[(3-fluorophenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 3-(2,6-dimethylphenyl)-1-(3-fluorobenzyl)-1-(3-morpholinopropyl)thiourea Formula: C23H30FN3OS MolecularWeight: 415.567203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)N(CCCN2CCOCC2)CC3=CC(=CC=C3)F

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)N(CCCN2CCOCC2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C23H30FN3OS/c1-18-6-3-7-19(2)22(18)25-23(29)27(17-20-8-4-9-21(24)16-20)11-5-10-26-12-14-28-15-13-26/h3-4,6-9,16H,5,10-15,17H2,1-2H3,(H,25,29)