1-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethanone

Systemtic Name: 1-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethanone Openeye Name: 1-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]-2-[2-(2-thienyl)pyrrolidin-1-yl]ethanone CAS Name: 1-[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]-2-(2-thiophen-2-yl-1-pyrrolidinyl)ethanone IUPAC Name: 1-[4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethanone Traditional Name: 1-[4-(2-chloro-6-fluoro-benzyl)piperazino]-2-[2-(2-thienyl)pyrrolidino]ethanone Formula: C21H25ClFN3OS MolecularWeight: 421.959103

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CC(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F)C4=CC=CS4

Isomeric SMILES

C1CC(N(C1)CC(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F)C4=CC=CS4

InChI

InChI=1S/C21H25ClFN3OS/c22-17-4-1-5-18(23)16(17)14-24-9-11-25(12-10-24)21(27)15-26-8-2-6-19(26)20-7-3-13-28-20/h1,3-5,7,13,19H,2,6,8-12,14-15H2