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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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