1-(6-methylheptan-2-yl)-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(6-methylheptan-2-yl)-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(1,5-dimethylhexyl)-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(6-methylheptan-2-yl)-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(6-methylheptan-2-yl)-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(1,5-dimethylhexyl)-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C16H23F3N2S MolecularWeight: 332.42743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=S)NC1=CC=CC=C1C(F)(F)F

Isomeric SMILES

CC(C)CCCC(C)NC(=S)NC1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C16H23F3N2S/c1-11(2)7-6-8-12(3)20-15(22)21-14-10-5-4-9-13(14)16(17,18)19/h4-5,9-12H,6-8H2,1-3H3,(H2,20,21,22)