[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [3-ethoxy-4-(3-pyridylmethoxy)phenyl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [3-ethoxy-4-(3-pyridinylmethoxy)phenyl]-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [3-ethoxy-4-(3-pyridylmethoxy)phenyl]-(4-tosylpiperazino)methanone Formula: C26H29N3O5S MolecularWeight: 495.59056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)OCC4=CN=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)OCC4=CN=CC=C4

InChI

InChI=1S/C26H29N3O5S/c1-3-33-25-17-22(8-11-24(25)34-19-21-5-4-12-27-18-21)26(30)28-13-15-29(16-14-28)35(31,32)23-9-6-20(2)7-10-23/h4-12,17-18H,3,13-16,19H2,1-2H3