[4-[(4-fluorophenyl)methyl-(oxolan-2-ylmethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone

Systemtic Name: [4-[(4-fluorophenyl)methyl-(oxolan-2-ylmethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [4-[(4-fluorophenyl)methyl-(tetrahydrofuran-2-ylmethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[(4-fluorophenyl)methyl-(2-oxolanylmethyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [4-[(4-fluorophenyl)methyl-(oxolan-2-ylmethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[(4-fluorobenzyl)-(tetrahydrofurfuryl)amino]-1-nicotinoyl-pyrrolidin-2-yl]-piperazino-methanone Formula: C27H34FN5O3 MolecularWeight: 495.588963

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2=CC=C(C=C2)F)C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)N5CCNCC5

Isomeric SMILES

C1CC(OC1)CN(CC2=CC=C(C=C2)F)C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)N5CCNCC5

InChI

InChI=1S/C27H34FN5O3/c28-22-7-5-20(6-8-22)17-32(19-24-4-2-14-36-24)23-15-25(27(35)31-12-10-29-11-13-31)33(18-23)26(34)21-3-1-9-30-16-21/h1,3,5-9,16,23-25,29H,2,4,10-15,17-19H2