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

Systemtic Name: 3-[(1-ethylpyrrolidin-2-yl)methyl]-1-(4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]thiourea Openeye Name: 3-[(1-ethylpyrrolidin-2-yl)methyl]-1-(4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]thiourea CAS Name: 3-[(1-ethyl-2-pyrrolidinyl)methyl]-1-(4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]thiourea IUPAC Name: 3-[(1-ethylpyrrolidin-2-yl)methyl]-1-(4-fluorophenyl)-1-[(2-hydroxyphenyl)methyl]thiourea Traditional Name: 3-[(1-ethylpyrrolidin-2-yl)methyl]-1-(4-fluorophenyl)-1-salicyl-thiourea Formula: C21H26FN3OS MolecularWeight: 387.514043

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=S)N(CC2=CC=CC=C2O)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1CCCC1CNC(=S)N(CC2=CC=CC=C2O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN3OS/c1-2-24-13-5-7-19(24)14-23-21(27)25(18-11-9-17(22)10-12-18)15-16-6-3-4-8-20(16)26/h3-4,6,8-12,19,26H,2,5,7,13-15H2,1H3,(H,23,27)