2-[[3-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]-2-methoxy-propyl]amino]pyrimidine-4-carboxamide

Systemtic Name: 2-[[3-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]-2-methoxy-propyl]amino]pyrimidine-4-carboxamide Openeye Name: 2-[[3-[4-(5-chloro-2-methoxy-phenyl)piperazin-1-yl]-2-methoxy-propyl]amino]pyrimidine-4-carboxamide CAS Name: 2-[[3-[4-(5-chloro-2-methoxyphenyl)-1-piperazinyl]-2-methoxypropyl]amino]-4-pyrimidinecarboxamide IUPAC Name: 2-[[3-[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]-2-methoxypropyl]amino]pyrimidine-4-carboxamide Traditional Name: 2-[[3-[4-(5-chloro-2-methoxy-phenyl)piperazino]-2-methoxy-propyl]amino]pyrimidine-4-carboxamide Formula: C20H27ClN6O3 MolecularWeight: 434.91978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(CNC3=NC=CC(=N3)C(=O)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(CNC3=NC=CC(=N3)C(=O)N)OC

InChI

InChI=1S/C20H27ClN6O3/c1-29-15(12-24-20-23-6-5-16(25-20)19(22)28)13-26-7-9-27(10-8-26)17-11-14(21)3-4-18(17)30-2/h3-6,11,15H,7-10,12-13H2,1-2H3,(H2,22,28)(H,23,24,25)