2-[3,5-dimethyl-4-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenoxy]pyrazol-1-yl]-4-pyridin-2-yl-pyrimidine

Systemtic Name: 2-[3,5-dimethyl-4-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenoxy]pyrazol-1-yl]-4-pyridin-2-yl-pyrimidine Openeye Name: 2-[4-[4-[(4-benzylpiperazin-1-yl)methyl]phenoxy]-3,5-dimethyl-pyrazol-1-yl]-4-(2-pyridyl)pyrimidine CAS Name: 2-[3,5-dimethyl-4-[4-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenoxy]-1-pyrazolyl]-4-(2-pyridinyl)pyrimidine IUPAC Name: 2-[4-[4-[(4-benzylpiperazin-1-yl)methyl]phenoxy]-3,5-dimethylpyrazol-1-yl]-4-pyridin-2-ylpyrimidine Traditional Name: 2-[4-[4-[(4-benzylpiperazino)methyl]phenoxy]-3,5-dimethyl-pyrazol-1-yl]-4-(2-pyridyl)pyrimidine Formula: C32H33N7O MolecularWeight: 531.65072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=NC=CC(=N2)C3=CC=CC=N3)C)OC4=CC=C(C=C4)CN5CCN(CC5)CC6=CC=CC=C6

Isomeric SMILES

CC1=C(C(=NN1C2=NC=CC(=N2)C3=CC=CC=N3)C)OC4=CC=C(C=C4)CN5CCN(CC5)CC6=CC=CC=C6

InChI

InChI=1S/C32H33N7O/c1-24-31(25(2)39(36-24)32-34-17-15-30(35-32)29-10-6-7-16-33-29)40-28-13-11-27(12-14-28)23-38-20-18-37(19-21-38)22-26-8-4-3-5-9-26/h3-17H,18-23H2,1-2H3