(2S)-2-[(5-methylpyrazin-2-yl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2S)-2-[(5-methylpyrazin-2-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: (2S)-2-[(5-methylpyrazine-2-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: (2S)-2-[[(5-methyl-2-pyrazinyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: (2S)-2-[(5-methylpyrazine-2-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: (2S)-2-[(5-methylpyrazinoyl)amino]-4-(methylthio)butyric acid Formula: C11H15N3O3S MolecularWeight: 269.3201

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N[C@@H](CCSC)C(=O)O

InChI

InChI=1S/C11H15N3O3S/c1-7-5-13-9(6-12-7)10(15)14-8(11(16)17)3-4-18-2/h5-6,8H,3-4H2,1-2H3,(H,14,15)(H,16,17)/t8-/m0/s1