N-[(2R)-2-cyano-3-methyl-butan-2-yl]-2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[(2R)-2-cyano-3-methyl-butan-2-yl]-2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: N-[(1R)-1-cyano-1,2-dimethyl-propyl]-2-(4-indan-5-ylsulfonylpiperazin-1-yl)acetamide CAS Name: N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]acetamide IUPAC Name: N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]acetamide Traditional Name: N-[(1R)-1-cyano-1,2-dimethyl-propyl]-2-(4-indan-5-ylsulfonylpiperazino)acetamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC3=C(CCC3)C=C2

Isomeric SMILES

CC(C)[C@](C)(C#N)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C21H30N4O3S/c1-16(2)21(3,15-22)23-20(26)14-24-9-11-25(12-10-24)29(27,28)19-8-7-17-5-4-6-18(17)13-19/h7-8,13,16H,4-6,9-12,14H2,1-3H3,(H,23,26)/t21-/m0/s1