4-ethyl-2-methyl-5-[(4-methylphenyl)methyl]-6-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 4-ethyl-2-methyl-5-[(4-methylphenyl)methyl]-6-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 4-ethyl-2-methyl-5-(p-tolylmethyl)-6-[4-[(E)-styryl]sulfonylpiperazin-1-yl]pyrimidine CAS Name: 4-ethyl-2-methyl-5-[(4-methylphenyl)methyl]-6-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 4-ethyl-2-methyl-5-[(4-methylphenyl)methyl]-6-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 4-ethyl-2-methyl-5-(4-methylbenzyl)-6-[4-[(E)-styryl]sulfonylpiperazino]pyrimidine Formula: C27H32N4O2S MolecularWeight: 476.63358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3)CC4=CC=C(C=C4)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3)CC4=CC=C(C=C4)C

InChI

InChI=1S/C27H32N4O2S/c1-4-26-25(20-24-12-10-21(2)11-13-24)27(29-22(3)28-26)30-15-17-31(18-16-30)34(32,33)19-14-23-8-6-5-7-9-23/h5-14,19H,4,15-18,20H2,1-3H3/b19-14+