N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-(4-p-cumenylsulfonylpiperazino)acetamide Formula: C21H32N4O3S MolecularWeight: 420.56878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC(C)(C#N)C(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)N[C@](C)(C#N)C(C)C

InChI

InChI=1S/C21H32N4O3S/c1-16(2)18-6-8-19(9-7-18)29(27,28)25-12-10-24(11-13-25)14-20(26)23-21(5,15-22)17(3)4/h6-9,16-17H,10-14H2,1-5H3,(H,23,26)/t21-/m1/s1