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

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-1-[(2-hydroxyphenyl)methyl]-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-(3-chloro-4-fluoro-phenyl)-1-[(2-hydroxyphenyl)methyl]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-(3-chloro-4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]thiourea Traditional Name: 3-benzyl-1-(3-chloro-4-fluoro-phenyl)-1-salicyl-thiourea Formula: C21H18ClFN2OS MolecularWeight: 400.896823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClFN2OS/c22-18-12-17(10-11-19(18)23)25(14-16-8-4-5-9-20(16)26)21(27)24-13-15-6-2-1-3-7-15/h1-12,26H,13-14H2,(H,24,27)