(2R)-N-(2-cyanophenyl)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: (2R)-N-(2-cyanophenyl)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: (2R)-2-(4-benzylsulfonylpiperazin-1-yl)-N-(2-cyanophenyl)propanamide CAS Name: (2R)-N-(2-cyanophenyl)-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: (2R)-2-(4-benzylsulfonylpiperazin-1-yl)-N-(2-cyanophenyl)propanamide Traditional Name: (2R)-2-(4-benzylsulfonylpiperazino)-N-(2-cyanophenyl)propionamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C#N)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O3S/c1-17(21(26)23-20-10-6-5-9-19(20)15-22)24-11-13-25(14-12-24)29(27,28)16-18-7-3-2-4-8-18/h2-10,17H,11-14,16H2,1H3,(H,23,26)/t17-/m1/s1