N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(2,5-dimethylphenyl)-4-piperidin-1-yl-piperidine-1-carbohydrazide

Systemtic Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(2,5-dimethylphenyl)-4-piperidin-1-yl-piperidine-1-carbohydrazide Openeye Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(2,5-dimethylphenyl)-4-(1-piperidyl)piperidine-1-carbohydrazide CAS Name: N'-[4-(1-azepanyl)-2-pyrimidinyl]-N-(2,5-dimethylphenyl)-4-(1-piperidinyl)-1-piperidinecarbohydrazide IUPAC Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(2,5-dimethylphenyl)-4-piperidin-1-ylpiperidine-1-carbohydrazide Traditional Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(2,5-dimethylphenyl)-4-piperidino-piperidine-1-carbohydrazide Formula: C29H43N7O MolecularWeight: 505.69802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(C(=O)N2CCC(CC2)N3CCCCC3)NC4=NC=CC(=N4)N5CCCCCC5

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(C(=O)N2CCC(CC2)N3CCCCC3)NC4=NC=CC(=N4)N5CCCCCC5

InChI

InChI=1S/C29H43N7O/c1-23-10-11-24(2)26(22-23)36(29(37)35-20-13-25(14-21-35)33-16-8-5-9-17-33)32-28-30-15-12-27(31-28)34-18-6-3-4-7-19-34/h10-12,15,22,25H,3-9,13-14,16-21H2,1-2H3,(H,30,31,32)