N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(3,5-dimethylphenyl)-4-piperidin-1-yl-piperidine-1-carbohydrazide

Systemtic Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(3,5-dimethylphenyl)-4-piperidin-1-yl-piperidine-1-carbohydrazide Openeye Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(3,5-dimethylphenyl)-4-(1-piperidyl)piperidine-1-carbohydrazide CAS Name: N'-[4-(1-azepanyl)-2-pyrimidinyl]-N-(3,5-dimethylphenyl)-4-(1-piperidinyl)-1-piperidinecarbohydrazide IUPAC Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(3,5-dimethylphenyl)-4-piperidin-1-ylpiperidine-1-carbohydrazide Traditional Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(3,5-dimethylphenyl)-4-piperidino-piperidine-1-carbohydrazide Formula: C29H43N7O MolecularWeight: 505.69802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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