1-butyl-3-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-butyl-3-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-butyl-3-[2-morpholino-5-(trifluoromethyl)phenyl]thiourea CAS Name: 1-butyl-3-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-butyl-3-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-butyl-3-[2-morpholino-5-(trifluoromethyl)phenyl]thiourea Formula: C16H22F3N3OS MolecularWeight: 361.42559

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=C(C=CC(=C1)C(F)(F)F)N2CCOCC2

Isomeric SMILES

CCCCNC(=S)NC1=C(C=CC(=C1)C(F)(F)F)N2CCOCC2

InChI

InChI=1S/C16H22F3N3OS/c1-2-3-6-20-15(24)21-13-11-12(16(17,18)19)4-5-14(13)22-7-9-23-10-8-22/h4-5,11H,2-3,6-10H2,1H3,(H2,20,21,24)