[1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]-[4-[(3-methylphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: [1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]-[4-[(3-methylphenyl)methyl]piperazin-1-yl]methanone Openeye Name: [1-(4-ethoxyphenyl)sulfonyl-4-piperidyl]-[4-(m-tolylmethyl)piperazin-1-yl]methanone CAS Name: [1-(4-ethoxyphenyl)sulfonyl-4-piperidinyl]-[4-[(3-methylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: [1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]-[4-[(3-methylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: [4-(3-methylbenzyl)piperazino]-(1-p-phenetylsulfonyl-4-piperidyl)methanone Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)CC4=CC=CC(=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)CC4=CC=CC(=C4)C

InChI

InChI=1S/C26H35N3O4S/c1-3-33-24-7-9-25(10-8-24)34(31,32)29-13-11-23(12-14-29)26(30)28-17-15-27(16-18-28)20-22-6-4-5-21(2)19-22/h4-10,19,23H,3,11-18,20H2,1-2H3