2-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]-4-methyl-6-piperidin-1-yl-pyrimidine

Systemtic Name: 2-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]-4-methyl-6-piperidin-1-yl-pyrimidine Openeye Name: 2-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]-4-methyl-6-(1-piperidyl)pyrimidine CAS Name: 2-[4-(4-butoxyphenyl)sulfonyl-1-piperazinyl]-4-methyl-6-(1-piperidinyl)pyrimidine IUPAC Name: 2-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]-4-methyl-6-piperidin-1-ylpyrimidine Traditional Name: 2-[4-(4-butoxyphenyl)sulfonylpiperazino]-4-methyl-6-piperidino-pyrimidine Formula: C24H35N5O3S MolecularWeight: 473.6314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=CC(=N3)N4CCCCC4)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=CC(=N3)N4CCCCC4)C

InChI

InChI=1S/C24H35N5O3S/c1-3-4-18-32-21-8-10-22(11-9-21)33(30,31)29-16-14-28(15-17-29)24-25-20(2)19-23(26-24)27-12-6-5-7-13-27/h8-11,19H,3-7,12-18H2,1-2H3