1-[4-(phenylmethyl)piperidin-1-yl]-2-(4-pyrrolidin-1-ylsulfonylimidazol-1-yl)ethanone

Systemtic Name: 1-[4-(phenylmethyl)piperidin-1-yl]-2-(4-pyrrolidin-1-ylsulfonylimidazol-1-yl)ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-(4-pyrrolidin-1-ylsulfonylimidazol-1-yl)ethanone CAS Name: 1-[4-(phenylmethyl)-1-piperidinyl]-2-[4-(1-pyrrolidinylsulfonyl)-1-imidazolyl]ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-(4-pyrrolidin-1-ylsulfonylimidazol-1-yl)ethanone Traditional Name: 1-(4-benzylpiperidino)-2-(4-pyrrolidinosulfonylimidazol-1-yl)ethanone Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN(C=N2)CC(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN(C=N2)CC(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H28N4O3S/c26-21(24-12-8-19(9-13-24)14-18-6-2-1-3-7-18)16-23-15-20(22-17-23)29(27,28)25-10-4-5-11-25/h1-3,6-7,15,17,19H,4-5,8-14,16H2