1-(3-chloranyl-4-fluoranyl-phenyl)-1-[(2-hydroxyphenyl)methyl]-3-(3-methoxyphenyl)thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-1-[(2-hydroxyphenyl)methyl]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-1-[(2-hydroxyphenyl)methyl]-3-(3-methoxyphenyl)thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(3-methoxyphenyl)-1-salicyl-thiourea Formula: C21H18ClFN2O2S MolecularWeight: 416.896223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N(CC2=CC=CC=C2O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N(CC2=CC=CC=C2O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H18ClFN2O2S/c1-27-17-7-4-6-15(11-17)24-21(28)25(13-14-5-2-3-8-20(14)26)16-9-10-19(23)18(22)12-16/h2-12,26H,13H2,1H3,(H,24,28)