[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-[1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]methanone

Systemtic Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-[1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]methanone Openeye Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-[1-(4-methoxypyrimidin-2-yl)-4-piperidyl]methanone CAS Name: [4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-[1-(4-methoxy-2-pyrimidinyl)-4-piperidinyl]methanone IUPAC Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-[1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]methanone Traditional Name: [1-(4-methoxypyrimidin-2-yl)-4-piperidyl]-(4-p-phenetylsulfonylpiperazino)methanone Formula: C23H31N5O5S MolecularWeight: 489.58774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCN(CC3)C4=NC=CC(=N4)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCN(CC3)C4=NC=CC(=N4)OC

InChI

InChI=1S/C23H31N5O5S/c1-3-33-19-4-6-20(7-5-19)34(30,31)28-16-14-26(15-17-28)22(29)18-9-12-27(13-10-18)23-24-11-8-21(25-23)32-2/h4-8,11,18H,3,9-10,12-17H2,1-2H3