[4-fluoranyl-4-[[(5-methylpyridin-2-yl)methylamino]methyl]piperidin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone

Systemtic Name: [4-fluoranyl-4-[[(5-methylpyridin-2-yl)methylamino]methyl]piperidin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone Openeye Name: [4-fluoro-4-[[(5-methyl-2-pyridyl)methylamino]methyl]-1-piperidyl]-(3-pyrrol-1-yl-2-thienyl)methanone CAS Name: [4-fluoro-4-[[(5-methyl-2-pyridinyl)methylamino]methyl]-1-piperidinyl]-[3-(1-pyrrolyl)-2-thiophenyl]methanone IUPAC Name: [4-fluoro-4-[[(5-methylpyridin-2-yl)methylamino]methyl]piperidin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone Traditional Name: [4-fluoro-4-[[(5-methyl-2-pyridyl)methylamino]methyl]piperidino]-(3-pyrrol-1-yl-2-thienyl)methanone Formula: C22H25FN4OS MolecularWeight: 412.523503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)CNCC2(CCN(CC2)C(=O)C3=C(C=CS3)N4C=CC=C4)F

Isomeric SMILES

CC1=CN=C(C=C1)CNCC2(CCN(CC2)C(=O)C3=C(C=CS3)N4C=CC=C4)F

InChI

InChI=1S/C22H25FN4OS/c1-17-4-5-18(25-14-17)15-24-16-22(23)7-11-27(12-8-22)21(28)20-19(6-13-29-20)26-9-2-3-10-26/h2-6,9-10,13-14,24H,7-8,11-12,15-16H2,1H3