4-(4-oxidanylpiperazin-1-yl)-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-amine

Systemtic Name: 4-(4-oxidanylpiperazin-1-yl)-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-amine Openeye Name: 4-(4-hydroxypiperazin-1-yl)-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-amine CAS Name: 4-(4-hydroxy-1-piperazinyl)-5-[(3,4,5-trimethoxyphenyl)methyl]-2-pyrimidinamine IUPAC Name: 4-(4-hydroxypiperazin-1-yl)-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-amine Traditional Name: [4-(4-hydroxypiperazino)-5-(3,4,5-trimethoxybenzyl)pyrimidin-2-yl]amine Formula: C18H25N5O4 MolecularWeight: 375.4222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N3CCN(CC3)O)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N3CCN(CC3)O)N

InChI

InChI=1S/C18H25N5O4/c1-25-14-9-12(10-15(26-2)16(14)27-3)8-13-11-20-18(19)21-17(13)22-4-6-23(24)7-5-22/h9-11,24H,4-8H2,1-3H3,(H2,19,20,21)