N-(2-cyclopentylpyrazol-3-yl)-3-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(2-cyclopentylpyrazol-3-yl)-3-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: 3-(4-benzylsulfonylpiperazin-1-yl)-N-(2-cyclopentylpyrazol-3-yl)propanamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-3-[4-(phenylmethyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: 3-(4-benzylsulfonylpiperazin-1-yl)-N-(2-cyclopentylpyrazol-3-yl)propanamide Traditional Name: 3-(4-benzylsulfonylpiperazino)-N-(2-cyclopentylpyrazol-3-yl)propionamide Formula: C22H31N5O3S MolecularWeight: 445.57824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CC=N2)NC(=O)CCN3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)N2C(=CC=N2)NC(=O)CCN3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H31N5O3S/c28-22(24-21-10-12-23-27(21)20-8-4-5-9-20)11-13-25-14-16-26(17-15-25)31(29,30)18-19-6-2-1-3-7-19/h1-3,6-7,10,12,20H,4-5,8-9,11,13-18H2,(H,24,28)