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

Systemtic Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(4-phenoxyphenyl)-4-piperidin-1-yl-piperidine-1-carbohydrazide Openeye Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(4-phenoxyphenyl)-4-(1-piperidyl)piperidine-1-carbohydrazide CAS Name: N'-[4-(1-azepanyl)-2-pyrimidinyl]-N-(4-phenoxyphenyl)-4-(1-piperidinyl)-1-piperidinecarbohydrazide IUPAC Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(4-phenoxyphenyl)-4-piperidin-1-ylpiperidine-1-carbohydrazide Traditional Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(4-phenoxyphenyl)-4-piperidino-piperidine-1-carbohydrazide Formula: C33H43N7O2 MolecularWeight: 569.74022

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC=C2)NN(C3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)N5CCC(CC5)N6CCCCC6

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC=C2)NN(C3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)N5CCC(CC5)N6CCCCC6

InChI

InChI=1S/C33H43N7O2/c41-33(39-25-18-27(19-26-39)37-21-9-4-10-22-37)40(28-13-15-30(16-14-28)42-29-11-5-3-6-12-29)36-32-34-20-17-31(35-32)38-23-7-1-2-8-24-38/h3,5-6,11-17,20,27H,1-2,4,7-10,18-19,21-26H2,(H,34,35,36)