N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(4-fluorophenyl)-4-piperidin-1-yl-piperidine-1-carbohydrazide

Systemtic Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(4-fluorophenyl)-4-piperidin-1-yl-piperidine-1-carbohydrazide Openeye Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(4-fluorophenyl)-4-(1-piperidyl)piperidine-1-carbohydrazide CAS Name: N'-[4-(1-azepanyl)-2-pyrimidinyl]-N-(4-fluorophenyl)-4-(1-piperidinyl)-1-piperidinecarbohydrazide IUPAC Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(4-fluorophenyl)-4-piperidin-1-ylpiperidine-1-carbohydrazide Traditional Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(4-fluorophenyl)-4-piperidino-piperidine-1-carbohydrazide Formula: C27H38FN7O MolecularWeight: 495.635323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC=C2)NN(C3=CC=C(C=C3)F)C(=O)N4CCC(CC4)N5CCCCC5

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC=C2)NN(C3=CC=C(C=C3)F)C(=O)N4CCC(CC4)N5CCCCC5

InChI

InChI=1S/C27H38FN7O/c28-22-8-10-24(11-9-22)35(27(36)34-20-13-23(14-21-34)32-16-6-3-7-17-32)31-26-29-15-12-25(30-26)33-18-4-1-2-5-19-33/h8-12,15,23H,1-7,13-14,16-21H2,(H,29,30,31)