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

Systemtic Name: 5-methoxy-2-[4-[4-(4-methylsulfonylphenyl)butyl]piperidin-1-yl]pyrimidine Openeye Name: 5-methoxy-2-[4-[4-(4-methylsulfonylphenyl)butyl]-1-piperidyl]pyrimidine CAS Name: 5-methoxy-2-[4-[4-(4-methylsulfonylphenyl)butyl]-1-piperidinyl]pyrimidine IUPAC Name: 5-methoxy-2-[4-[4-(4-methylsulfonylphenyl)butyl]piperidin-1-yl]pyrimidine Traditional Name: 2-[4-[4-(4-mesylphenyl)butyl]piperidino]-5-methoxy-pyrimidine Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN=C(N=C1)N2CCC(CC2)CCCCC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COC1=CN=C(N=C1)N2CCC(CC2)CCCCC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H29N3O3S/c1-27-19-15-22-21(23-16-19)24-13-11-18(12-14-24)6-4-3-5-17-7-9-20(10-8-17)28(2,25)26/h7-10,15-16,18H,3-6,11-14H2,1-2H3