4-piperidin-1-yl-6-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]pyrimidine

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4

InChI

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