(2R)-2-[2-(4-ethylpiperazin-1-yl)ethanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2R)-2-[2-(4-ethylpiperazin-1-yl)ethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: (2R)-2-[[2-(4-ethylpiperazin-1-yl)acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: (2R)-2-[[2-(4-ethyl-1-piperazinyl)-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: (2R)-2-[[2-(4-ethylpiperazin-1-yl)acetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: (2R)-2-[[2-(4-ethylpiperazino)acetyl]amino]-4-(methylthio)butyric acid Formula: C13H25N3O3S MolecularWeight: 303.4209

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CCN1CCN(CC1)CC(=O)N[C@H](CCSC)C(=O)O

InChI

InChI=1S/C13H25N3O3S/c1-3-15-5-7-16(8-6-15)10-12(17)14-11(13(18)19)4-9-20-2/h11H,3-10H2,1-2H3,(H,14,17)(H,18,19)/t11-/m1/s1