methyl (2R)-4-methyl-2-[2-[4-(phenylsulfonyl)piperazin-1-yl]ethanoylamino]pentanoate

Systemtic Name: methyl (2R)-4-methyl-2-[2-[4-(phenylsulfonyl)piperazin-1-yl]ethanoylamino]pentanoate Openeye Name: methyl (2R)-2-[[2-[4-(benzenesulfonyl)piperazin-1-yl]acetyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[2-[4-(benzenesulfonyl)-1-piperazinyl]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[4-(benzenesulfonyl)piperazin-1-yl]acetyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[2-(4-besylpiperazino)acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C19H29N3O5S MolecularWeight: 411.51566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@H](C(=O)OC)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H29N3O5S/c1-15(2)13-17(19(24)27-3)20-18(23)14-21-9-11-22(12-10-21)28(25,26)16-7-5-4-6-8-16/h4-8,15,17H,9-14H2,1-3H3,(H,20,23)/t17-/m1/s1