4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-methyl-6-piperidin-1-yl-pyrimidine

Systemtic Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-methyl-6-piperidin-1-yl-pyrimidine Openeye Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-methyl-6-(1-piperidyl)pyrimidine CAS Name: 4-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-2-methyl-6-(1-piperidinyl)pyrimidine IUPAC Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-methyl-6-piperidin-1-ylpyrimidine Traditional Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-2-methyl-6-piperidino-pyrimidine Formula: C22H31N5O2S MolecularWeight: 429.57884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3)N4CCCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3)N4CCCCC4)C

InChI

InChI=1S/C22H31N5O2S/c1-17-7-8-18(2)20(15-17)30(28,29)27-13-11-26(12-14-27)22-16-21(23-19(3)24-22)25-9-5-4-6-10-25/h7-8,15-16H,4-6,9-14H2,1-3H3