3-(3-ethylphenyl)-1-(4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]thiourea

Systemtic Name: 3-(3-ethylphenyl)-1-(4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]thiourea Openeye Name: 3-(3-ethylphenyl)-1-(4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]thiourea CAS Name: 3-(3-ethylphenyl)-1-(4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]thiourea IUPAC Name: 3-(3-ethylphenyl)-1-(4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]thiourea Traditional Name: 3-(3-ethylphenyl)-1-(4-fluorophenyl)-1-salicyl-thiourea Formula: C22H21FN2OS MolecularWeight: 380.478343

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)N(CC2=CC=CC=C2O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)N(CC2=CC=CC=C2O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H21FN2OS/c1-2-16-6-5-8-19(14-16)24-22(27)25(20-12-10-18(23)11-13-20)15-17-7-3-4-9-21(17)26/h3-14,26H,2,15H2,1H3,(H,24,27)