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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4)C

InChI

InChI=1S/C22H31N5O2S/c1-17-13-19(3)20(14-18(17)2)30(28,29)27-11-9-26(10-12-27)22-15-21(23-16-24-22)25-7-5-4-6-8-25/h13-16H,4-12H2,1-3H3