3-(cyclohexylmethyl)-N-[1-(phenylmethyl)piperidin-4-yl]-3-(phenylsulfonyl)-1,3-thiazolidin-3-ium-4-carbothioamide

Systemtic Name: 3-(cyclohexylmethyl)-N-[1-(phenylmethyl)piperidin-4-yl]-3-(phenylsulfonyl)-1,3-thiazolidin-3-ium-4-carbothioamide Openeye Name: 3-(benzenesulfonyl)-N-(1-benzyl-4-piperidyl)-3-(cyclohexylmethyl)thiazolidin-3-ium-4-carbothioamide CAS Name: 3-(benzenesulfonyl)-3-(cyclohexylmethyl)-N-[1-(phenylmethyl)-4-piperidinyl]-4-thiazolidin-3-iumcarbothioamide IUPAC Name: 3-(benzenesulfonyl)-N-(1-benzylpiperidin-4-yl)-3-(cyclohexylmethyl)-1,3-thiazolidin-3-ium-4-carbothioamide Traditional Name: N-(1-benzyl-4-piperidyl)-3-besyl-3-(cyclohexylmethyl)thiazolidin-3-ium-4-carbothioamide Formula: C29H40N3O2S3+ MolecularWeight: 558.8418

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C[N+]2(CSCC2C(=S)NC3CCN(CC3)CC4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C[N+]2(CSCC2C(=S)NC3CCN(CC3)CC4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H39N3O2S3/c33-37(34,27-14-8-3-9-15-27)32(21-25-12-6-2-7-13-25)23-36-22-28(32)29(35)30-26-16-18-31(19-17-26)20-24-10-4-1-5-11-24/h1,3-5,8-11,14-15,25-26,28H,2,6-7,12-13,16-23H2/p+1