[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-(4-methylphenyl)sulfonylpiperidin-4-yl]-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone Openeye Name: [1-(p-tolylsulfonyl)-4-piperidyl]-[4-(2-thienylmethyl)piperazin-1-yl]methanone CAS Name: [1-(4-methylphenyl)sulfonyl-4-piperidinyl]-[4-(thiophen-2-ylmethyl)-1-piperazinyl]methanone IUPAC Name: [1-(4-methylphenyl)sulfonylpiperidin-4-yl]-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone Traditional Name: [4-(2-thenyl)piperazino]-(1-tosyl-4-piperidyl)methanone Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)CC4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)CC4=CC=CS4

InChI

InChI=1S/C22H29N3O3S2/c1-18-4-6-21(7-5-18)30(27,28)25-10-8-19(9-11-25)22(26)24-14-12-23(13-15-24)17-20-3-2-16-29-20/h2-7,16,19H,8-15,17H2,1H3