N-[(4-fluorophenyl)-thiophen-2-yl-methyl]-2-(5-pyrrolidin-1-ylcarbonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(4-fluorophenyl)-thiophen-2-yl-methyl]-2-(5-pyrrolidin-1-ylcarbonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(4-fluorophenyl)-(2-thienyl)methyl]-2-[[5-(pyrrolidine-1-carbonyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-2-[[5-[oxo(1-pyrrolidinyl)methyl]-2-pyridinyl]thio]acetamide IUPAC Name: N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-2-[5-(pyrrolidine-1-carbonyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-[(4-fluorophenyl)-(2-thienyl)methyl]-2-[[5-(pyrrolidine-1-carbonyl)-2-pyridyl]thio]acetamide Formula: C23H22FN3O2S2 MolecularWeight: 455.568083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CN=C(C=C2)SCC(=O)NC(C3=CC=C(C=C3)F)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)C(=O)C2=CN=C(C=C2)SCC(=O)NC(C3=CC=C(C=C3)F)C4=CC=CS4

InChI

InChI=1S/C23H22FN3O2S2/c24-18-8-5-16(6-9-18)22(19-4-3-13-30-19)26-20(28)15-31-21-10-7-17(14-25-21)23(29)27-11-1-2-12-27/h3-10,13-14,22H,1-2,11-12,15H2,(H,26,28)