1-pentyl-3-[4-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-pentyl-3-[4-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-pentyl-3-[4-(trifluoromethyl)phenyl]thiourea CAS Name: 1-pentyl-3-[4-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-pentyl-3-[4-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-amyl-3-[4-(trifluoromethyl)phenyl]thiourea Formula: C13H17F3N2S MolecularWeight: 290.34769

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NC1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CCCCCNC(=S)NC1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C13H17F3N2S/c1-2-3-4-9-17-12(19)18-11-7-5-10(6-8-11)13(14,15)16/h5-8H,2-4,9H2,1H3,(H2,17,18,19)