(2S)-2-[[(5-azanylpyridin-2-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[[(5-azanylpyridin-2-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[(5-amino-2-pyridyl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[[(5-amino-2-pyridinyl)methyl-methylamino]-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[(5-aminopyridin-2-yl)methyl-methylcarbamoyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[(5-amino-2-pyridyl)methyl-methyl-carbamoyl]amino]-3-methyl-butyric acid Formula: C13H20N4O3 MolecularWeight: 280.3229

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N4O3/c1-8(2)11(12(18)19)16-13(20)17(3)7-10-5-4-9(14)6-15-10/h4-6,8,11H,7,14H2,1-3H3,(H,16,20)(H,18,19)/t11-/m0/s1