[(3R)-1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [(3R)-1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: [(3R)-1-(4-methoxyphenyl)sulfonyl-3-piperidyl]-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: [(3R)-1-(4-methoxyphenyl)sulfonyl-3-piperidinyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [(3R)-1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: [(3R)-1-(4-methoxyphenyl)sulfonyl-3-piperidyl]-[4-(2-pyridyl)piperazino]methanone Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C22H28N4O4S/c1-30-19-7-9-20(10-8-19)31(28,29)26-12-4-5-18(17-26)22(27)25-15-13-24(14-16-25)21-6-2-3-11-23-21/h2-3,6-11,18H,4-5,12-17H2,1H3/t18-/m1/s1