2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(2-methylpropyl)-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(2-methylpropyl)-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 3-isobutyl-2-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 2-[[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]thio]-3-(2-methylpropyl)-6-oxo-4-pyrimidinolate IUPAC Name: 2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanyl-3-(2-methylpropyl)-6-oxopyrimidin-4-olate Traditional Name: 3-isobutyl-6-keto-2-[[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]pyrimidin-4-olate Formula: C14H17N4O4S- MolecularWeight: 337.37418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSC2=NC(=O)C=C(N2CC(C)C)[O-]

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CSC2=NC(=O)C=C(N2CC(C)C)[O-]

InChI

InChI=1S/C14H18N4O4S/c1-8(2)6-18-13(21)5-11(19)16-14(18)23-7-12(20)15-10-4-9(3)22-17-10/h4-5,8,21H,6-7H2,1-3H3,(H,15,17,20)/p-1