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

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-(4-quinolin-2-ylthiophen-2-yl)thiourea Openeye Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(2-quinolyl)-2-thienyl]thiourea CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(2-quinolinyl)-2-thiophenyl]thiourea IUPAC Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-(4-quinolin-2-ylthiophen-2-yl)thiourea Traditional Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(2-quinolyl)-2-thienyl]thiourea Formula: C21H13ClF3N3S2 MolecularWeight: 463.92623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H13ClF3N3S2/c22-16-7-6-14(10-15(16)21(23,24)25)26-20(29)28-19-9-13(11-30-19)18-8-5-12-3-1-2-4-17(12)27-18/h1-11H,(H2,26,28,29)