1-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]-3-(3-methoxyphenyl)thiourea

Systemtic Name: 1-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]-3-(3-methoxyphenyl)thiourea Formula: C14H12ClF3N4OS MolecularWeight: 376.78449

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NNC2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NNC2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C14H12ClF3N4OS/c1-23-10-4-2-3-9(6-10)20-13(24)22-21-12-11(15)5-8(7-19-12)14(16,17)18/h2-7H,1H3,(H,19,21)(H2,20,22,24)