methyl 4-[[4-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]phenyl]methyl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[[4-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]phenyl]methyl]piperazine-1-carboxylate Openeye Name: methyl 4-[[4-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]phenyl]methyl]piperazine-1-carboxylate CAS Name: 4-[[4-[[5-(4-methoxyphenyl)-2-pyrimidinyl]amino]phenyl]methyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[[4-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]phenyl]methyl]piperazine-1-carboxylate Traditional Name: 4-[4-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]benzyl]piperazine-1-carboxylic acid methyl ester Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(N=C2)NC3=CC=C(C=C3)CN4CCN(CC4)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C(N=C2)NC3=CC=C(C=C3)CN4CCN(CC4)C(=O)OC

InChI

InChI=1S/C24H27N5O3/c1-31-22-9-5-19(6-10-22)20-15-25-23(26-16-20)27-21-7-3-18(4-8-21)17-28-11-13-29(14-12-28)24(30)32-2/h3-10,15-16H,11-14,17H2,1-2H3,(H,25,26,27)