[1-(4-methylphenyl)sulfonylpiperidin-2-yl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-(4-methylphenyl)sulfonylpiperidin-2-yl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: [1-(p-tolylsulfonyl)-2-piperidyl]-[4-(3-thienylmethyl)piperazin-1-yl]methanone CAS Name: [1-(4-methylphenyl)sulfonyl-2-piperidinyl]-[4-(3-thiophenylmethyl)-1-piperazinyl]methanone IUPAC Name: [1-(4-methylphenyl)sulfonylpiperidin-2-yl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: [4-(3-thenyl)piperazino]-(1-tosyl-2-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)N2CCCCC2C(=O)N3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)N3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C22H29N3O3S2/c1-18-5-7-20(8-6-18)30(27,28)25-10-3-2-4-21(25)22(26)24-13-11-23(12-14-24)16-19-9-15-29-17-19/h5-9,15,17,21H,2-4,10-14,16H2,1H3