1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-(4-quinolin-2-ylsulfonylphenyl)thiourea

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-(4-quinolin-2-ylsulfonylphenyl)thiourea Openeye Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(2-quinolylsulfonyl)phenyl]thiourea CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(2-quinolinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-(4-quinolin-2-ylsulfonylphenyl)thiourea Traditional Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(2-quinolylsulfonyl)phenyl]thiourea Formula: C23H15ClF3N3O2S2 MolecularWeight: 521.96231

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=CC(=C(C=C4)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=CC(=C(C=C4)Cl)C(F)(F)F

InChI

InChI=1S/C23H15ClF3N3O2S2/c24-19-11-8-16(13-18(19)23(25,26)27)29-22(33)28-15-6-9-17(10-7-15)34(31,32)21-12-5-14-3-1-2-4-20(14)30-21/h1-13H,(H2,28,29,33)