(2S)-4-methyl-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrido[3,2-d]pyrimidin-3-yl)pentanoic acid

Systemtic Name: (2S)-4-methyl-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrido[3,2-d]pyrimidin-3-yl)pentanoic acid Openeye Name: (2S)-4-methyl-2-(4-oxo-2-thioxo-1H-pyrido[3,2-d]pyrimidin-3-yl)pentanoic acid CAS Name: (2S)-4-methyl-2-(4-oxo-2-sulfanylidene-1H-pyrido[3,2-d]pyrimidin-3-yl)pentanoic acid IUPAC Name: (2S)-4-methyl-2-(4-oxo-2-sulfanylidene-1H-pyrido[3,2-d]pyrimidin-3-yl)pentanoic acid Traditional Name: (2S)-2-(4-keto-2-thioxo-1H-pyrido[3,2-d]pyrimidin-3-yl)-4-methyl-valeric acid Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N1C(=O)C2=C(C=CC=N2)NC1=S

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)N1C(=O)C2=C(C=CC=N2)NC1=S

InChI

InChI=1S/C13H15N3O3S/c1-7(2)6-9(12(18)19)16-11(17)10-8(15-13(16)20)4-3-5-14-10/h3-5,7,9H,6H2,1-2H3,(H,15,20)(H,18,19)/t9-/m0/s1