2-[(3S,5S)-4-[(3,4-dimethoxyphenyl)methyl]-3,5-dimethyl-piperazin-1-yl]pyrimidine

Systemtic Name: 2-[(3S,5S)-4-[(3,4-dimethoxyphenyl)methyl]-3,5-dimethyl-piperazin-1-yl]pyrimidine Openeye Name: 2-[(3S,5S)-4-[(3,4-dimethoxyphenyl)methyl]-3,5-dimethyl-piperazin-1-yl]pyrimidine CAS Name: 2-[(3S,5S)-4-[(3,4-dimethoxyphenyl)methyl]-3,5-dimethyl-1-piperazinyl]pyrimidine IUPAC Name: 2-[(3S,5S)-4-[(3,4-dimethoxyphenyl)methyl]-3,5-dimethylpiperazin-1-yl]pyrimidine Traditional Name: 2-[(3S,5S)-3,5-dimethyl-4-veratryl-piperazino]pyrimidine Formula: C19H26N4O2 MolecularWeight: 342.43534

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1CC2=CC(=C(C=C2)OC)OC)C)C3=NC=CC=N3

Isomeric SMILES

C[C@H]1CN(C[C@@H](N1CC2=CC(=C(C=C2)OC)OC)C)C3=NC=CC=N3

InChI

InChI=1S/C19H26N4O2/c1-14-11-22(19-20-8-5-9-21-19)12-15(2)23(14)13-16-6-7-17(24-3)18(10-16)25-4/h5-10,14-15H,11-13H2,1-4H3/t14-,15-/m0/s1