2-[4-[4-(4-methylsulfonylphenyl)butyl]piperidin-1-yl]pyrimidine

Systemtic Name: 2-[4-[4-(4-methylsulfonylphenyl)butyl]piperidin-1-yl]pyrimidine Openeye Name: 2-[4-[4-(4-methylsulfonylphenyl)butyl]-1-piperidyl]pyrimidine CAS Name: 2-[4-[4-(4-methylsulfonylphenyl)butyl]-1-piperidinyl]pyrimidine IUPAC Name: 2-[4-[4-(4-methylsulfonylphenyl)butyl]piperidin-1-yl]pyrimidine Traditional Name: 2-[4-[4-(4-mesylphenyl)butyl]piperidino]pyrimidine Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CCCCC2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CCCCC2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C20H27N3O2S/c1-26(24,25)19-9-7-17(8-10-19)5-2-3-6-18-11-15-23(16-12-18)20-21-13-4-14-22-20/h4,7-10,13-14,18H,2-3,5-6,11-12,15-16H2,1H3