5-chloranyl-6-[(3R)-4-[6-(4-fluorophenyl)-2-pyrrolidin-1-yl-pyrimidin-4-yl]-3-methyl-piperazin-1-yl]pyridine-3-carboxamide

Systemtic Name: 5-chloranyl-6-[(3R)-4-[6-(4-fluorophenyl)-2-pyrrolidin-1-yl-pyrimidin-4-yl]-3-methyl-piperazin-1-yl]pyridine-3-carboxamide Openeye Name: 5-chloro-6-[(3R)-4-[6-(4-fluorophenyl)-2-pyrrolidin-1-yl-pyrimidin-4-yl]-3-methyl-piperazin-1-yl]pyridine-3-carboxamide CAS Name: 5-chloro-6-[(3R)-4-[6-(4-fluorophenyl)-2-(1-pyrrolidinyl)-4-pyrimidinyl]-3-methyl-1-piperazinyl]-3-pyridinecarboxamide IUPAC Name: 5-chloro-6-[(3R)-4-[6-(4-fluorophenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]-3-methylpiperazin-1-yl]pyridine-3-carboxamide Traditional Name: 5-chloro-6-[(3R)-4-[6-(4-fluorophenyl)-2-pyrrolidino-pyrimidin-4-yl]-3-methyl-piperazino]nicotinamide Formula: C25H27ClFN7O MolecularWeight: 495.979583

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=NC(=NC(=C2)C3=CC=C(C=C3)F)N4CCCC4)C5=C(C=C(C=N5)C(=O)N)Cl

Isomeric SMILES

C[C@@H]1CN(CCN1C2=NC(=NC(=C2)C3=CC=C(C=C3)F)N4CCCC4)C5=C(C=C(C=N5)C(=O)N)Cl

InChI

InChI=1S/C25H27ClFN7O/c1-16-15-33(24-20(26)12-18(14-29-24)23(28)35)10-11-34(16)22-13-21(17-4-6-19(27)7-5-17)30-25(31-22)32-8-2-3-9-32/h4-7,12-14,16H,2-3,8-11,15H2,1H3,(H2,28,35)/t16-/m1/s1