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

Systemtic Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(3,4-dichlorophenyl)-4-piperidin-1-yl-piperidine-1-carbohydrazide Openeye Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(3,4-dichlorophenyl)-4-(1-piperidyl)piperidine-1-carbohydrazide CAS Name: N'-[4-(1-azepanyl)-2-pyrimidinyl]-N-(3,4-dichlorophenyl)-4-(1-piperidinyl)-1-piperidinecarbohydrazide IUPAC Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(3,4-dichlorophenyl)-4-piperidin-1-ylpiperidine-1-carbohydrazide Traditional Name: N'-[4-(azepan-1-yl)pyrimidin-2-yl]-N-(3,4-dichlorophenyl)-4-piperidino-piperidine-1-carbohydrazide Formula: C27H37Cl2N7O MolecularWeight: 546.53498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37Cl2N7O/c28-23-9-8-22(20-24(23)29)36(27(37)35-18-11-21(12-19-35)33-14-6-3-7-15-33)32-26-30-13-10-25(31-26)34-16-4-1-2-5-17-34/h8-10,13,20-21H,1-7,11-12,14-19H2,(H,30,31,32)