1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-(1,3-dimethylpyrazol-4-yl)thiourea

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-(1,3-dimethylpyrazol-4-yl)thiourea Openeye Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-(1,3-dimethylpyrazol-4-yl)thiourea CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-(1,3-dimethyl-4-pyrazolyl)thiourea IUPAC Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-(1,3-dimethylpyrazol-4-yl)thiourea Traditional Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-(1,3-dimethylpyrazol-4-yl)thiourea Formula: C13H12ClF3N4S MolecularWeight: 348.77439

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1NC(=S)NC2=CC(=C(C=C2)Cl)C(F)(F)F)C

Isomeric SMILES

CC1=NN(C=C1NC(=S)NC2=CC(=C(C=C2)Cl)C(F)(F)F)C

InChI

InChI=1S/C13H12ClF3N4S/c1-7-11(6-21(2)20-7)19-12(22)18-8-3-4-10(14)9(5-8)13(15,16)17/h3-6H,1-2H3,(H2,18,19,22)