azetidin-3-yl-[4-[4-[(2,4-dichlorophenyl)methylamino]pyrimidin-2-yl]piperazin-1-yl]methanone

Systemtic Name: azetidin-3-yl-[4-[4-[(2,4-dichlorophenyl)methylamino]pyrimidin-2-yl]piperazin-1-yl]methanone Openeye Name: azetidin-3-yl-[4-[4-[(2,4-dichlorophenyl)methylamino]pyrimidin-2-yl]piperazin-1-yl]methanone CAS Name: 3-azetidinyl-[4-[4-[(2,4-dichlorophenyl)methylamino]-2-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: azetidin-3-yl-[4-[4-[(2,4-dichlorophenyl)methylamino]pyrimidin-2-yl]piperazin-1-yl]methanone Traditional Name: azetidin-3-yl-[4-[4-[(2,4-dichlorobenzyl)amino]pyrimidin-2-yl]piperazino]methanone Formula: C19H22Cl2N6O MolecularWeight: 421.32358

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC(=N2)NCC3=C(C=C(C=C3)Cl)Cl)C(=O)C4CNC4

Isomeric SMILES

C1CN(CCN1C2=NC=CC(=N2)NCC3=C(C=C(C=C3)Cl)Cl)C(=O)C4CNC4

InChI

InChI=1S/C19H22Cl2N6O/c20-15-2-1-13(16(21)9-15)12-24-17-3-4-23-19(25-17)27-7-5-26(6-8-27)18(28)14-10-22-11-14/h1-4,9,14,22H,5-8,10-12H2,(H,23,24,25)