2-[4-[(2-azanylpyrimidin-5-yl)methyl]-1-[(4-methoxy-2,3-dimethyl-phenyl)methyl]piperazin-2-yl]ethanol

Systemtic Name: 2-[4-[(2-azanylpyrimidin-5-yl)methyl]-1-[(4-methoxy-2,3-dimethyl-phenyl)methyl]piperazin-2-yl]ethanol Openeye Name: 2-[4-[(2-aminopyrimidin-5-yl)methyl]-1-[(4-methoxy-2,3-dimethyl-phenyl)methyl]piperazin-2-yl]ethanol CAS Name: 2-[4-[(2-amino-5-pyrimidinyl)methyl]-1-[(4-methoxy-2,3-dimethylphenyl)methyl]-2-piperazinyl]ethanol IUPAC Name: 2-[4-[(2-aminopyrimidin-5-yl)methyl]-1-[(4-methoxy-2,3-dimethylphenyl)methyl]piperazin-2-yl]ethanol Traditional Name: 2-[4-[(2-aminopyrimidin-5-yl)methyl]-1-(4-methoxy-2,3-dimethyl-benzyl)piperazin-2-yl]ethanol Formula: C21H31N5O2 MolecularWeight: 385.50314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)OC)CN2CCN(CC2CCO)CC3=CN=C(N=C3)N

Isomeric SMILES

CC1=C(C=CC(=C1C)OC)CN2CCN(CC2CCO)CC3=CN=C(N=C3)N

InChI

InChI=1S/C21H31N5O2/c1-15-16(2)20(28-3)5-4-18(15)13-26-8-7-25(14-19(26)6-9-27)12-17-10-23-21(22)24-11-17/h4-5,10-11,19,27H,6-9,12-14H2,1-3H3,(H2,22,23,24)