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

Systemtic Name: 1-(2-morpholin-4-ylethyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(2-morpholinoethyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[2-(4-morpholinyl)ethyl]-3-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(2-morpholin-4-ylethyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(2-morpholinoethyl)-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Formula: C17H20F3N5OS MolecularWeight: 399.43381

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3C=CC=N3

Isomeric SMILES

C1COCCN1CCNC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3C=CC=N3

InChI

InChI=1S/C17H20F3N5OS/c18-17(19,20)13-2-3-15(25-6-1-4-22-25)14(12-13)23-16(27)21-5-7-24-8-10-26-11-9-24/h1-4,6,12H,5,7-11H2,(H2,21,23,27)