1-[bis(4-tert-butylphenoxy)phosphinothioylamino]-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[bis(4-tert-butylphenoxy)phosphinothioylamino]-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[bis(4-tert-butylphenoxy)phosphinothioylamino]-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[bis(4-tert-butylphenoxy)phosphinothioylamino]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[bis(4-tert-butylphenoxy)phosphinothioylamino]-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[bis(4-tert-butylphenoxy)thiophosphorylamino]-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C28H33F3N3O2PS2 MolecularWeight: 595.679491

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OP(=S)(NNC(=S)NC2=CC=CC(=C2)C(F)(F)F)OC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OP(=S)(NNC(=S)NC2=CC=CC(=C2)C(F)(F)F)OC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C28H33F3N3O2PS2/c1-26(2,3)19-10-14-23(15-11-19)35-37(39,36-24-16-12-20(13-17-24)27(4,5)6)34-33-25(38)32-22-9-7-8-21(18-22)28(29,30)31/h7-18H,1-6H3,(H,34,39)(H2,32,33,38)