2-chloranyl-1-[4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-chloranyl-1-[4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]propan-1-one Openeye Name: 2-chloro-1-[4-[6-ethyl-2-methyl-5-(p-tolylmethyl)pyrimidin-4-yl]piperazin-1-yl]propan-1-one CAS Name: 2-chloro-1-[4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]-4-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-chloro-1-[4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]propan-1-one Traditional Name: 2-chloro-1-[4-[6-ethyl-2-methyl-5-(4-methylbenzyl)pyrimidin-4-yl]piperazino]propan-1-one Formula: C22H29ClN4O MolecularWeight: 400.94486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C(C)Cl)CC3=CC=C(C=C3)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C(C)Cl)CC3=CC=C(C=C3)C

InChI

InChI=1S/C22H29ClN4O/c1-5-20-19(14-18-8-6-15(2)7-9-18)21(25-17(4)24-20)26-10-12-27(13-11-26)22(28)16(3)23/h6-9,16H,5,10-14H2,1-4H3