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

Systemtic Name: 2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-methyl-6-piperidin-1-yl-pyrimidine Openeye Name: 2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-methyl-6-(1-piperidyl)pyrimidine CAS Name: 2-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-4-methyl-6-(1-piperidinyl)pyrimidine IUPAC Name: 2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-methyl-6-piperidin-1-ylpyrimidine Traditional Name: 2-[4-(4-methoxyphenyl)sulfonylpiperazino]-4-methyl-6-piperidino-pyrimidine Formula: C21H29N5O3S MolecularWeight: 431.55166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)N4CCCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)N4CCCCC4

InChI

InChI=1S/C21H29N5O3S/c1-17-16-20(24-10-4-3-5-11-24)23-21(22-17)25-12-14-26(15-13-25)30(27,28)19-8-6-18(29-2)7-9-19/h6-9,16H,3-5,10-15H2,1-2H3