[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-yl]-(1-pyrimidin-2-ylpiperidin-4-yl)methanone

Systemtic Name: [4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-yl]-(1-pyrimidin-2-ylpiperidin-4-yl)methanone Openeye Name: [4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-(1-pyrimidin-2-yl-4-piperidyl)methanone CAS Name: [4-[2-(4-chlorophenoxy)ethyl]-1-piperazinyl]-[1-(2-pyrimidinyl)-4-piperidinyl]methanone IUPAC Name: [4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-(1-pyrimidin-2-ylpiperidin-4-yl)methanone Traditional Name: [4-[2-(4-chlorophenoxy)ethyl]piperazino]-[1-(2-pyrimidyl)-4-piperidyl]methanone Formula: C22H28ClN5O2 MolecularWeight: 429.94302

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)CCOC3=CC=C(C=C3)Cl)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)CCOC3=CC=C(C=C3)Cl)C4=NC=CC=N4

InChI

InChI=1S/C22H28ClN5O2/c23-19-2-4-20(5-3-19)30-17-16-26-12-14-27(15-13-26)21(29)18-6-10-28(11-7-18)22-24-8-1-9-25-22/h1-5,8-9,18H,6-7,10-17H2