1-[2-methoxy-5-(trifluoromethyl)phenyl]-3-(4-pyridin-4-ylsulfanylphenyl)urea

Systemtic Name: 1-[2-methoxy-5-(trifluoromethyl)phenyl]-3-(4-pyridin-4-ylsulfanylphenyl)urea Openeye Name: 1-[2-methoxy-5-(trifluoromethyl)phenyl]-3-[4-(4-pyridylsulfanyl)phenyl]urea CAS Name: 1-[2-methoxy-5-(trifluoromethyl)phenyl]-3-[4-(pyridin-4-ylthio)phenyl]urea IUPAC Name: 1-[2-methoxy-5-(trifluoromethyl)phenyl]-3-(4-pyridin-4-ylsulfanylphenyl)urea Traditional Name: 1-[2-methoxy-5-(trifluoromethyl)phenyl]-3-[4-(4-pyridylthio)phenyl]urea Formula: C20H16F3N3O2S MolecularWeight: 419.42015

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(F)(F)F)NC(=O)NC2=CC=C(C=C2)SC3=CC=NC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C(F)(F)F)NC(=O)NC2=CC=C(C=C2)SC3=CC=NC=C3

InChI

InChI=1S/C20H16F3N3O2S/c1-28-18-7-2-13(20(21,22)23)12-17(18)26-19(27)25-14-3-5-15(6-4-14)29-16-8-10-24-11-9-16/h2-12H,1H3,(H2,25,26,27)