1-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[1-(1-naphthylmethyl)pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[1-(1-naphthalenylmethyl)-4-pyrazolyl]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[1-(1-naphthylmethyl)pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C22H17F3N4S MolecularWeight: 426.45739

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CN3C=C(C=N3)NC(=S)NC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CN3C=C(C=N3)NC(=S)NC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C22H17F3N4S/c23-22(24,25)19-10-3-4-11-20(19)28-21(30)27-17-12-26-29(14-17)13-16-8-5-7-15-6-1-2-9-18(15)16/h1-12,14H,13H2,(H2,27,28,30)