1-[2-(naphthalen-1-ylmethylsulfanyl)ethanoylamino]-3-[4-(trifluoromethyloxy)phenyl]thiourea

Systemtic Name: 1-[2-(naphthalen-1-ylmethylsulfanyl)ethanoylamino]-3-[4-(trifluoromethyloxy)phenyl]thiourea Openeye Name: 1-[[2-(1-naphthylmethylsulfanyl)acetyl]amino]-3-[4-(trifluoromethoxy)phenyl]thiourea CAS Name: 1-[[2-(1-naphthalenylmethylthio)-1-oxoethyl]amino]-3-[4-(trifluoromethoxy)phenyl]thiourea IUPAC Name: 1-[[2-(naphthalen-1-ylmethylsulfanyl)acetyl]amino]-3-[4-(trifluoromethoxy)phenyl]thiourea Traditional Name: 1-[[2-(1-naphthylmethylthio)acetyl]amino]-3-[4-(trifluoromethoxy)phenyl]thiourea Formula: C21H18F3N3O2S2 MolecularWeight: 465.51173

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSCC(=O)NNC(=S)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSCC(=O)NNC(=S)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H18F3N3O2S2/c22-21(23,24)29-17-10-8-16(9-11-17)25-20(30)27-26-19(28)13-31-12-15-6-3-5-14-4-1-2-7-18(14)15/h1-11H,12-13H2,(H,26,28)(H2,25,27,30)