1-[2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylethanoylamino]-3-phenyl-thiourea

Systemtic Name: 1-[2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylethanoylamino]-3-phenyl-thiourea Openeye Name: 1-[[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]acetyl]amino]-3-phenyl-thiourea CAS Name: 1-[[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]-1-oxoethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanylacetyl]amino]-3-phenylthiourea Traditional Name: 1-[[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]acetyl]amino]-3-phenyl-thiourea Formula: C15H12ClF3N4OS2 MolecularWeight: 420.86019

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=O)CSC2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=O)CSC2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C15H12ClF3N4OS2/c16-11-6-9(15(17,18)19)7-20-13(11)26-8-12(24)22-23-14(25)21-10-4-2-1-3-5-10/h1-7H,8H2,(H,22,24)(H2,21,23,25)